ChemDiv1_014528
TL;DR: ChemDiv1_014528 (CAS 422534-05-2) is a chemical compound with molecular formula C21H14N4O5S and molecular weight 434.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-oxochromene-3-carboxamide
Also Known As: ChemDiv1_014528, F0529-0103, N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-2-oxo-2H-chromene-3-carboxamide, N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-oxochromene-3-carboxamide, N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-oxo-2H-chromene-3-carboxamide
| Molecular Formula | C21H14N4O5S |
|---|---|
| Molecular Weight | 434.07 g/mol |
| LogP | 3.886 |
| Topological Polar Surface Area | 120.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 434.06848 |
| Heavy Atoms | 31 |
| Complexity | 1407.8102 |
Chemical Identifiers
| CAS Number | 422534-05-2 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC5=CC=CC=C5OC4=O |
Product Overview
ChemDiv1_014528 (CAS 422534-05-2), with molecular formula C21H14N4O5S and molecular weight 434.07 g/mol. IUPAC: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-oxochromene-3-carboxamide.
Chemical Property Profile of ChemDiv1_014528
Property Insights of ChemDiv1_014528
The XLogP value of 3.886 indicates that ChemDiv1_014528 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.27 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014528. Following Lipinski's Rule of Five, ChemDiv1_014528 has 1 hydrogen bond donor(s) and 7 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_014528?
The CAS number of ChemDiv1_014528 is 422534-05-2.
What is the molecular formula of ChemDiv1_014528?
The molecular formula of ChemDiv1_014528 is C21H14N4O5S.
What is the molecular weight of ChemDiv1_014528?
The molecular weight of ChemDiv1_014528 is 434.07 g/mol.
Where can I buy ChemDiv1_014528?
You can request a quote for ChemDiv1_014528 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014528?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.