![N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide structure](/static/products/4382/438214-49-4.webp)
N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
TL;DR: N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide (CAS 438214-49-4) is a chemical compound with molecular formula C23H16N4O3S and molecular weight 428.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Also Known As: N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide, N-{4-nitrophenyl}-N'-[(2-phenyl-4-quinolinyl)carbonyl]thiourea, N-(4-NITROPHENYL)-N'-[(2-PHENYL-4-QUINOLYL)CARBONYL]THIOUREA
| Molecular Formula | C23H16N4O3S |
|---|---|
| Molecular Weight | 428.09 g/mol |
| LogP | 4.9368 |
| Topological Polar Surface Area | 97.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.0943 |
| Heavy Atoms | 31 |
| Complexity | 1291.4767 |
Chemical Identifiers
| CAS Number | 438214-49-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide (CAS 438214-49-4), with molecular formula C23H16N4O3S and molecular weight 428.09 g/mol. IUPAC: N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide.
Chemical Property Profile of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Property Insights of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
The XLogP value of 4.9368 indicates that N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide. Following Lipinski's Rule of Five, N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide has 2 hydrogen bond donor(s) and 5 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 N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide?
The CAS number of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide is 438214-49-4.
What is the molecular formula of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide?
The molecular formula of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide is C23H16N4O3S.
What is the molecular weight of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide?
The molecular weight of N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide is 428.09 g/mol.
Where can I buy N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide?
You can request a quote for N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.