VU0511119-1
TL;DR: VU0511119-1 (CAS 901008-31-9) is a chemical compound with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-N-(2,3-dimethylphenyl)-1-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]triazole-4-carboxamide
Also Known As: VU0511119-1, 5-amino-N-(2,3-dimethylphenyl)-1-({[(4-methylphenyl)methyl]carbamoyl}methyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-N-(2,3-dimethylphenyl)-1-(2-((4-methylbenzyl)amino)-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-N-(2,3-dimethylphenyl)-1-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]triazole-4-carboxamide
| Molecular Formula | C21H24N6O2 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 2.35426 |
| Topological Polar Surface Area | 114.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.19608 |
| Heavy Atoms | 29 |
| Complexity | 1039.825 |
Chemical Identifiers
| CAS Number | 901008-31-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=CC(=C3C)C)N |
Product Overview
VU0511119-1 (CAS 901008-31-9), with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol. IUPAC: 5-amino-N-(2,3-dimethylphenyl)-1-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]triazole-4-carboxamide.
Chemical Property Profile of VU0511119-1
Property Insights of VU0511119-1
The XLogP value of 2.35426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0511119-1. The TPSA of 114.93 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0511119-1. Following Lipinski's Rule of Five, VU0511119-1 has 3 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 VU0511119-1?
The CAS number of VU0511119-1 is 901008-31-9.
What is the molecular formula of VU0511119-1?
The molecular formula of VU0511119-1 is C21H24N6O2.
What is the molecular weight of VU0511119-1?
The molecular weight of VU0511119-1 is 392.20 g/mol.
Where can I buy VU0511119-1?
You can request a quote for VU0511119-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0511119-1?
Yes, KEHONG BIO provides custom synthesis services for VU0511119-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.