N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
TL;DR: N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide (CAS 219619-30-4) is a chemical compound with molecular formula C12H7N3O4S and molecular weight 289.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
Also Known As: N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide, BAS 00315379, N2-(1,3-benzothiazol-2-yl)-5-nitro-2-furamide, N-(benzo[d]thiazol-2-yl)-5-nitrofuran-2-carboxamide, N-(1,3-Benzothiazol-2-yl)-5-nitro-2-furamide
| Molecular Formula | C12H7N3O4S |
|---|---|
| Molecular Weight | 289.02 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.01572 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 219619-30-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | INEMNYHCDSBKGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide (CAS 219619-30-4), with molecular formula C12H7N3O4S and molecular weight 289.02 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
Property Insights of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
The XLogP value of 3.1 indicates that N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-5-nitrofuran-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-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide is 219619-30-4.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide is C12H7N3O4S.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide is 289.02 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-5-nitrofuran-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-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.