4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
TL;DR: 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide (CAS 315232-48-5) is a chemical compound with molecular formula C21H13N3O4S and molecular weight 403.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Also Known As: 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide, 4-benzoyl-N-(6-nitrobenzo[d]thiazol-2-yl)benzamide, F0015-0788
| Molecular Formula | C21H13N3O4S |
|---|---|
| Molecular Weight | 403.06 g/mol |
| LogP | 4.6878 |
| Topological Polar Surface Area | 102.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.06268 |
| Heavy Atoms | 29 |
| Complexity | 1234.0234 |
Chemical Identifiers
| CAS Number | 315232-48-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-] |
Product Overview
4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide (CAS 315232-48-5), with molecular formula C21H13N3O4S and molecular weight 403.06 g/mol. IUPAC: 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Property Insights of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
The XLogP value of 4.6878 indicates that 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide 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 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The CAS number of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is 315232-48-5.
What is the molecular formula of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The molecular formula of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is C21H13N3O4S.
What is the molecular weight of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The molecular weight of 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is 403.06 g/mol.
Where can I buy 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
You can request a quote for 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.