2-(4-Amino-3-nitrobenzoyl)thiophene
TL;DR: 2-(4-Amino-3-nitrobenzoyl)thiophene (CAS 31431-30-8) is a chemical compound with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-3-nitrophenyl)-thiophen-2-ylmethanone
Also Known As: 2-(4-Amino-3-nitrobenzoyl)thiophene, 2- thiophene, (4-Amino-3-nitrophenyl)-(2-thienyl)methanon, (4-amino-3-nitrophenyl)-thiophen-2-ylmethanone, JSPY-st000020
| Molecular Formula | C11H8N2O3S |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | 2.4695 |
| Topological Polar Surface Area | 86.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.02556 |
| Heavy Atoms | 17 |
| Complexity | 578.4074 |
Chemical Identifiers
| CAS Number | 31431-30-8 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-] |
Product Overview
2-(4-Amino-3-nitrobenzoyl)thiophene (CAS 31431-30-8), with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol. IUPAC: (4-amino-3-nitrophenyl)-thiophen-2-ylmethanone.
Chemical Property Profile of 2-(4-Amino-3-nitrobenzoyl)thiophene
Property Insights of 2-(4-Amino-3-nitrobenzoyl)thiophene
The XLogP value of 2.4695 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Amino-3-nitrobenzoyl)thiophene. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Amino-3-nitrobenzoyl)thiophene. Following Lipinski's Rule of Five, 2-(4-Amino-3-nitrobenzoyl)thiophene has 1 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 2-(4-Amino-3-nitrobenzoyl)thiophene?
The CAS number of 2-(4-Amino-3-nitrobenzoyl)thiophene is 31431-30-8.
What is the molecular formula of 2-(4-Amino-3-nitrobenzoyl)thiophene?
The molecular formula of 2-(4-Amino-3-nitrobenzoyl)thiophene is C11H8N2O3S.
What is the molecular weight of 2-(4-Amino-3-nitrobenzoyl)thiophene?
The molecular weight of 2-(4-Amino-3-nitrobenzoyl)thiophene is 248.03 g/mol.
Where can I buy 2-(4-Amino-3-nitrobenzoyl)thiophene?
You can request a quote for 2-(4-Amino-3-nitrobenzoyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Amino-3-nitrobenzoyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Amino-3-nitrobenzoyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.