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N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide
TL;DR: N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide (CAS 696605-92-2) is a chemical compound with molecular formula C13H15N5O2 and molecular weight 273.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide
Also Known As: A3565/0151223, N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide, N-(3,5-DIMETHYL-4H-1,2,4-TRIAZOL-4-YL)-N'-(3-METHYLBENZOYL)UREA, N-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide, Urea, 1-(3,5-dimethyl-[1,2,4]triazol-4-yl)-3-(3-methylbenzoyl)-
| Molecular Formula | C13H15N5O2 |
|---|---|
| Molecular Weight | 273.12 g/mol |
| LogP | 1.29686 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.1226 |
| Heavy Atoms | 20 |
| Complexity | 643.0312 |
Chemical Identifiers
| CAS Number | 696605-92-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=O)NN2C(=NN=C2C)C |
Product Overview
N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide (CAS 696605-92-2), with molecular formula C13H15N5O2 and molecular weight 273.12 g/mol. IUPAC: N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide.
Chemical Property Profile of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide
Property Insights of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide
The XLogP value of 1.29686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide. Following Lipinski's Rule of Five, N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide has 2 hydrogen bond donor(s) and 4 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 N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide?
The CAS number of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide is 696605-92-2.
What is the molecular formula of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide?
The molecular formula of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide is C13H15N5O2.
What is the molecular weight of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide?
The molecular weight of N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide is 273.12 g/mol.
Where can I buy N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide?
You can request a quote for N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.