VU0609359-1
TL;DR: VU0609359-1 (CAS 904817-69-2) is a chemical compound with molecular formula C19H17ClN4O3 and molecular weight 384.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[1-(5-chloro-2-methylphenyl)-5-methyltriazole-4-carbonyl]amino]benzoate
Also Known As: VU0609359-1, F3296-0618, methyl 2-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-amido]benzoate, methyl 2-(1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamido)benzoate, methyl 2-[[1-(5-chloro-2-methylphenyl)-5-methyltriazole-4-carbonyl]amino]benzoate
| Molecular Formula | C19H17ClN4O3 |
|---|---|
| Molecular Weight | 384.10 g/mol |
| LogP | 3.57644 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.0989 |
| Heavy Atoms | 27 |
| Complexity | 1029.5443 |
Chemical Identifiers
| CAS Number | 904817-69-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N2C(=C(N=N2)C(=O)NC3=CC=CC=C3C(=O)OC)C |
Product Overview
VU0609359-1 (CAS 904817-69-2), with molecular formula C19H17ClN4O3 and molecular weight 384.10 g/mol. IUPAC: methyl 2-[[1-(5-chloro-2-methylphenyl)-5-methyltriazole-4-carbonyl]amino]benzoate.
Chemical Property Profile of VU0609359-1
Property Insights of VU0609359-1
The XLogP value of 3.57644 indicates that VU0609359-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0609359-1. Following Lipinski's Rule of Five, VU0609359-1 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 VU0609359-1?
The CAS number of VU0609359-1 is 904817-69-2.
What is the molecular formula of VU0609359-1?
The molecular formula of VU0609359-1 is C19H17ClN4O3.
What is the molecular weight of VU0609359-1?
The molecular weight of VU0609359-1 is 384.10 g/mol.
Where can I buy VU0609359-1?
You can request a quote for VU0609359-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0609359-1?
Yes, KEHONG BIO provides custom synthesis services for VU0609359-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.