3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
TL;DR: 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide (CAS 308294-63-5) is a chemical compound with molecular formula C16H13N3O5S and molecular weight 359.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Also Known As: 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide, 3,5-dimethoxy-N-(6-nitrobenzo[d]thiazol-2-yl)benzamide, AE-848/08646062, 3,5-Dimethoxy-N-(6-nitro-2-benzothiazolyl)benzamide, F0015-0782
| Molecular Formula | C16H13N3O5S |
|---|---|
| Molecular Weight | 359.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.0576 |
| Heavy Atoms | 25 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 308294-63-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OC |
| InChIKey | UKCKDNOCQHIQLO-UHFFFAOYSA-N |
Product Overview
3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide (CAS 308294-63-5), with molecular formula C16H13N3O5S and molecular weight 359.06 g/mol. IUPAC: 3,5-dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Property Insights of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
The XLogP value of 3.3 indicates that 3,5-Dimethoxy-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 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 7 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 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The CAS number of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is 308294-63-5.
What is the molecular formula of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The molecular formula of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is C16H13N3O5S.
What is the molecular weight of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
The molecular weight of 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide is 359.06 g/mol.
Where can I buy 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
You can request a quote for 3,5-Dimethoxy-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 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.