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N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
TL;DR: N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide (CAS 426240-18-8) is a chemical compound with molecular formula C12H9N3O3S2 and molecular weight 307.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
Also Known As: N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide, 1-(2-NITROPHENYL)-3-(THIOPHENE-2-CARBONYL)THIOUREA
| Molecular Formula | C12H9N3O3S2 |
|---|---|
| Molecular Weight | 307.01 g/mol |
| LogP | 2.7831 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.00854 |
| Heavy Atoms | 20 |
| Complexity | 655.727 |
Chemical Identifiers
| CAS Number | 426240-18-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=S)NC(=O)C2=CC=CS2)[N+](=O)[O-] |
Product Overview
N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide (CAS 426240-18-8), with molecular formula C12H9N3O3S2 and molecular weight 307.01 g/mol. IUPAC: N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
Property Insights of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide
The XLogP value of 2.7831 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide. Following Lipinski's Rule of Five, N-[(2-nitrophenyl)carbamothioyl]thiophene-2-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-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide?
The CAS number of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide is 426240-18-8.
What is the molecular formula of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide?
The molecular formula of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide is C12H9N3O3S2.
What is the molecular weight of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide?
The molecular weight of N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide is 307.01 g/mol.
Where can I buy N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide?
You can request a quote for N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-nitrophenyl)carbamothioyl]thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.