ChemDiv1_005173
TL;DR: ChemDiv1_005173 (CAS 396722-30-8) is a chemical compound with molecular formula C24H26N4O6S and molecular weight 498.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-triethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: ChemDiv1_005173, 3,4,5-triethoxy-N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, F0778-0243, 3,4,5-triethoxy-N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]benzamide, 3,4,5-triethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C24H26N4O6S |
|---|---|
| Molecular Weight | 498.16 g/mol |
| LogP | 4.9757 |
| Topological Polar Surface Area | 117.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 498.15732 |
| Heavy Atoms | 35 |
| Complexity | 1214.5516 |
Chemical Identifiers
| CAS Number | 396722-30-8 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
ChemDiv1_005173 (CAS 396722-30-8), with molecular formula C24H26N4O6S and molecular weight 498.16 g/mol. IUPAC: 3,4,5-triethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of ChemDiv1_005173
Property Insights of ChemDiv1_005173
The XLogP value of 4.9757 indicates that ChemDiv1_005173 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_005173. Following Lipinski's Rule of Five, ChemDiv1_005173 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_005173?
The CAS number of ChemDiv1_005173 is 396722-30-8.
What is the molecular formula of ChemDiv1_005173?
The molecular formula of ChemDiv1_005173 is C24H26N4O6S.
What is the molecular weight of ChemDiv1_005173?
The molecular weight of ChemDiv1_005173 is 498.16 g/mol.
Where can I buy ChemDiv1_005173?
You can request a quote for ChemDiv1_005173 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005173?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005173 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.