![N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide structure](/static/products/6429/642977-56-8.webp)
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide
TL;DR: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide (CAS 642977-56-8) is a chemical compound with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide
Also Known As: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide, N-{[(2-hydroxy-4-nitrophenyl)amino]carbonothioyl}cyclohexanecarboxamide
| Molecular Formula | C14H17N3O4S |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 2.6937 |
| Topological Polar Surface Area | 104.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.09396 |
| Heavy Atoms | 22 |
| Complexity | 599.7508 |
Chemical Identifiers
| CAS Number | 642977-56-8 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide (CAS 642977-56-8), with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol. IUPAC: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide.
Chemical Property Profile of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide
Property Insights of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide
The XLogP value of 2.6937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide. The TPSA of 104.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide. Following Lipinski's Rule of Five, N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide has 3 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-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide?
The CAS number of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide is 642977-56-8.
What is the molecular formula of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide?
The molecular formula of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide is C14H17N3O4S.
What is the molecular weight of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide?
The molecular weight of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide is 323.09 g/mol.
Where can I buy N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide?
You can request a quote for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.