4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
TL;DR: 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CAS 329196-75-0) is a chemical compound with molecular formula C17H13N3O3S and molecular weight 339.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
Also Known As: BAS 00835809, BIM-0005654.P001, 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide, 4-Methyl-3-nitro-N-(4-phenyl-thiazol-2-yl)-benzamide, 3-nitro-4-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
| Molecular Formula | C17H13N3O3S |
|---|---|
| Molecular Weight | 339.07 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.06775 |
| Heavy Atoms | 24 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 329196-75-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-] |
| InChIKey | KDTBRANYLGZVLT-UHFFFAOYSA-N |
Product Overview
4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CAS 329196-75-0), with molecular formula C17H13N3O3S and molecular weight 339.07 g/mol. IUPAC: 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
Chemical Property Profile of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
Property Insights of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
The XLogP value of 4.0 indicates that 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 5 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-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The CAS number of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is 329196-75-0.
What is the molecular formula of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The molecular formula of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is C17H13N3O3S.
What is the molecular weight of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The molecular weight of 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is 339.07 g/mol.
Where can I buy 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
You can request a quote for 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-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-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.