4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 444933-02-2) is a chemical compound with molecular formula C16H12N4O3S and molecular weight 340.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-nitro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide, 3-methyl-4-nitro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide, 3-METHYL-4-NITRO-N~1~-(5-PHENYL-1,3,4-THIADIAZOL-2-YL)BENZAMIDE
| Molecular Formula | C16H12N4O3S |
|---|---|
| Molecular Weight | 340.06 g/mol |
| LogP | 3.67402 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.06302 |
| Heavy Atoms | 24 |
| Complexity | 908.6958 |
Chemical Identifiers
| CAS Number | 444933-02-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)C3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 444933-02-2), with molecular formula C16H12N4O3S and molecular weight 340.06 g/mol. IUPAC: 3-methyl-4-nitro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 3.67402 indicates that 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-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-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide is 444933-02-2.
What is the molecular formula of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide is C16H12N4O3S.
What is the molecular weight of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide is 340.06 g/mol.
Where can I buy 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-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-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.