![(5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide structure](/static/products/879/879459-18-4.png)
(5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide
TL;DR: (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide (CAS 879459-18-4) is a chemical compound with molecular formula C25H24N4O4S and molecular weight 476.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-3-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-5-carboxamide
Also Known As: (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide, 5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide, N-(3-((furan-2-ylmethyl)carbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-5-carboxamide, N-{3-[(furan-2-ylmethyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-5-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-3-carboxamide
| Molecular Formula | C25H24N4O4S |
|---|---|
| Molecular Weight | 476.15 g/mol |
| LogP | 4.72464 |
| Topological Polar Surface Area | 120.25 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.15182 |
| Heavy Atoms | 34 |
| Complexity | 1384.3 |
Chemical Identifiers
| CAS Number | 879459-18-4 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C2=NNC(=C2)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)NCC5=CC=CO5)O)C |
Product Overview
(5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide (CAS 879459-18-4), with molecular formula C25H24N4O4S and molecular weight 476.15 g/mol. IUPAC: N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-3-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide
Property Insights of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide
The XLogP value of 4.72464 indicates that (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.25 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide. Following Lipinski's Rule of Five, (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide?
The CAS number of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide is 879459-18-4.
What is the molecular formula of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide?
The molecular formula of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide is C25H24N4O4S.
What is the molecular weight of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide?
The molecular weight of (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide is 476.15 g/mol.
Where can I buy (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide?
You can request a quote for (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-1,2-dihydropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.