UPCMLD0ENAT0508-2481:001
TL;DR: UPCMLD0ENAT0508-2481:001 (CAS 380462-36-2) is a chemical compound with molecular formula C19H20N4O3S and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: UPCMLD0ENAT0508-2481:001, 4-[(1Z)-2-(2,4,5-trimethoxyphenyl)-1-azavinyl]-5-(4-methylphenyl)-1,2,4-triazo le-3-thiol, 5-(p-tolyl)-4-((2,4,5-trimethoxybenzylidene)amino)-4H-1,2,4-triazole-3-thiol, 3-(4-methylphenyl)-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
| Molecular Formula | C19H20N4O3S |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 3.82411 |
| Topological Polar Surface Area | 73.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.1256 |
| Heavy Atoms | 27 |
| Complexity | 1022.4243 |
Chemical Identifiers
| CAS Number | 380462-36-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3OC)OC)OC |
Product Overview
UPCMLD0ENAT0508-2481:001 (CAS 380462-36-2), with molecular formula C19H20N4O3S and molecular weight 384.13 g/mol. IUPAC: 3-(4-methylphenyl)-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of UPCMLD0ENAT0508-2481:001
Property Insights of UPCMLD0ENAT0508-2481:001
The XLogP value of 3.82411 indicates that UPCMLD0ENAT0508-2481:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.66 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0508-2481:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0508-2481:001 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 UPCMLD0ENAT0508-2481:001?
The CAS number of UPCMLD0ENAT0508-2481:001 is 380462-36-2.
What is the molecular formula of UPCMLD0ENAT0508-2481:001?
The molecular formula of UPCMLD0ENAT0508-2481:001 is C19H20N4O3S.
What is the molecular weight of UPCMLD0ENAT0508-2481:001?
The molecular weight of UPCMLD0ENAT0508-2481:001 is 384.13 g/mol.
Where can I buy UPCMLD0ENAT0508-2481:001?
You can request a quote for UPCMLD0ENAT0508-2481:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0508-2481:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0508-2481:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.