ChemDiv1_014484
TL;DR: ChemDiv1_014484 (CAS 444185-11-9) is a chemical compound with molecular formula C23H22N4O6S and molecular weight 482.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Also Known As: ChemDiv1_014484, F0529-0092, (2E)-N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide, (E)-N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-3-(3,4,5-trimethoxyphenyl)acrylamide, (E)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
| Molecular Formula | C23H22N4O6S |
|---|---|
| Molecular Weight | 482.13 g/mol |
| LogP | 4.205 |
| Topological Polar Surface Area | 117.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.126 |
| Heavy Atoms | 34 |
| Complexity | 1244.2051 |
Chemical Identifiers
| CAS Number | 444185-11-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
ChemDiv1_014484 (CAS 444185-11-9), with molecular formula C23H22N4O6S and molecular weight 482.13 g/mol. IUPAC: (E)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide.
Chemical Property Profile of ChemDiv1_014484
Property Insights of ChemDiv1_014484
The XLogP value of 4.205 indicates that ChemDiv1_014484 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014484. Following Lipinski's Rule of Five, ChemDiv1_014484 has 1 hydrogen bond donor(s) and 8 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 ChemDiv1_014484?
The CAS number of ChemDiv1_014484 is 444185-11-9.
What is the molecular formula of ChemDiv1_014484?
The molecular formula of ChemDiv1_014484 is C23H22N4O6S.
What is the molecular weight of ChemDiv1_014484?
The molecular weight of ChemDiv1_014484 is 482.13 g/mol.
Where can I buy ChemDiv1_014484?
You can request a quote for ChemDiv1_014484 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014484?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014484 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.