![(3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one structure](/static/products/880/880393-41-9.png)
(3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
TL;DR: (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one (CAS 880393-41-9) is a chemical compound with molecular formula C29H28ClN3O4 and molecular weight 517.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 4-(3-chlorophenyl)-5-(3,4-dimethoxyphenethyl)-3-(2-hydroxy-3,5-dimethylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one, 4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one, 4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
| Molecular Formula | C29H28ClN3O4 |
|---|---|
| Molecular Weight | 517.18 g/mol |
| LogP | 5.85764 |
| Topological Polar Surface Area | 87.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 517.1768 |
| Heavy Atoms | 37 |
| Complexity | 1496.7527 |
Chemical Identifiers
| CAS Number | 880393-41-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C2=NNC3=C2C(N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C5=CC(=CC=C5)Cl)O)C |
Product Overview
(3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one (CAS 880393-41-9), with molecular formula C29H28ClN3O4 and molecular weight 517.18 g/mol. IUPAC: 4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
Property Insights of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
The XLogP value of 5.85764 indicates that (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one. Following Lipinski's Rule of Five, (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one?
The CAS number of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one is 880393-41-9.
What is the molecular formula of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one?
The molecular formula of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one is C29H28ClN3O4.
What is the molecular weight of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one?
The molecular weight of (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one is 517.18 g/mol.
Where can I buy (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one?
You can request a quote for (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.