N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide
TL;DR: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide (CAS 328539-52-2) is a chemical compound with molecular formula C20H13N3O4S and molecular weight 391.06 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)-2-phenoxybenzamide
Also Known As: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide, N-(6-nitrobenzo[d]thiazol-2-yl)-2-phenoxybenzamide, F0147-0037
| Molecular Formula | C20H13N3O4S |
|---|---|
| Molecular Weight | 391.06 g/mol |
| LogP | 5.2491 |
| Topological Polar Surface Area | 94.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.06268 |
| Heavy Atoms | 28 |
| Complexity | 1174.5231 |
Chemical Identifiers
| CAS Number | 328539-52-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-] |
Product Overview
N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide (CAS 328539-52-2), with molecular formula C20H13N3O4S and molecular weight 391.06 g/mol. IUPAC: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide.
Chemical Property Profile of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide
Property Insights of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide
The XLogP value of 5.2491 indicates that N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide. Following Lipinski's Rule of Five, N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide?
The CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide is 328539-52-2.
What is the molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide?
The molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide is C20H13N3O4S.
What is the molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide?
The molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide is 391.06 g/mol.
Where can I buy N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide?
You can request a quote for N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide 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)-2-phenoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.