N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
TL;DR: N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide (CAS 301858-48-0) is a chemical compound with molecular formula C12H7N3O3S2 and molecular weight 304.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
Also Known As: N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide, N-(6-nitrobenzothiazol-2-yl)-2-thienylcarboxamide, F0015-0785, N-(6-nitrobenzo[d]thiazol-2-yl)thiophene-2-carboxamide
| Molecular Formula | C12H7N3O3S2 |
|---|---|
| Molecular Weight | 304.99 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.9929 |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 301858-48-0 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-] |
| InChIKey | FSNIXLWOQCMYJY-UHFFFAOYSA-N |
Product Overview
N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide (CAS 301858-48-0), with molecular formula C12H7N3O3S2 and molecular weight 304.99 g/mol. IUPAC: N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide.
Chemical Property Profile of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
Property Insights of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
The XLogP value of 3.4 indicates that N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide has 1 hydrogen bond donor(s) and 6 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-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide?
The CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide is 301858-48-0.
What is the molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide?
The molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide is C12H7N3O3S2.
What is the molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide?
The molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide is 304.99 g/mol.
Where can I buy N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide?
You can request a quote for N-(6-nitro-1,3-benzothiazol-2-yl)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-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-nitro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.