VU0511113-1
TL;DR: VU0511113-1 (CAS 899726-65-9) is a chemical compound with molecular formula C20H21ClN4O2 and molecular weight 384.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methoxyphenyl)-5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carboxamide
Also Known As: VU0511113-1, F3165-0276, N-(3-chloro-4-methoxyphenyl)-5-methyl-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide, N-(3-chloro-4-methoxyphenyl)-1-(4-isopropylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide, N-(3-chloro-4-methoxyphenyl)-5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carboxamide
| Molecular Formula | C20H21ClN4O2 |
|---|---|
| Molecular Weight | 384.14 g/mol |
| LogP | 4.61342 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.1353 |
| Heavy Atoms | 27 |
| Complexity | 964.6131 |
Chemical Identifiers
| CAS Number | 899726-65-9 |
|---|---|
| SMILES | CC1=C(N=NN1C2=CC=C(C=C2)C(C)C)C(=O)NC3=CC(=C(C=C3)OC)Cl |
Product Overview
VU0511113-1 (CAS 899726-65-9), with molecular formula C20H21ClN4O2 and molecular weight 384.14 g/mol. IUPAC: N-(3-chloro-4-methoxyphenyl)-5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carboxamide.
Chemical Property Profile of VU0511113-1
Property Insights of VU0511113-1
The XLogP value of 4.61342 indicates that VU0511113-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0511113-1. Following Lipinski's Rule of Five, VU0511113-1 has 1 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 VU0511113-1?
The CAS number of VU0511113-1 is 899726-65-9.
What is the molecular formula of VU0511113-1?
The molecular formula of VU0511113-1 is C20H21ClN4O2.
What is the molecular weight of VU0511113-1?
The molecular weight of VU0511113-1 is 384.14 g/mol.
Where can I buy VU0511113-1?
You can request a quote for VU0511113-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0511113-1?
Yes, KEHONG BIO provides custom synthesis services for VU0511113-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.