12T-0282
TL;DR: 12T-0282 (CAS 860786-56-7) is a chemical compound with molecular formula C23H20ClN3O2 and molecular weight 405.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]-5-methyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one
Also Known As: 12T-0282, 4-[4-(benzyloxy)phenyl]-2-(4-chlorobenzyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one, 2-[(4-chlorophenyl)methyl]-5-methyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one, 4-[4-(benzyloxy)phenyl]-1-[(4-chlorophenyl)methyl]-3-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one, 4-[4-(benzyloxy)phenyl]-2-[(4-chlorophenyl)methyl]-5-methyl-1,2,4-triazol-3-one
| Molecular Formula | C23H20ClN3O2 |
|---|---|
| Molecular Weight | 405.12 g/mol |
| LogP | 4.62312 |
| Topological Polar Surface Area | 49.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.1244 |
| Heavy Atoms | 29 |
| Complexity | 1147.7097 |
Chemical Identifiers
| CAS Number | 860786-56-7 |
|---|---|
| SMILES | CC1=NN(C(=O)N1C2=CC=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)Cl |
Product Overview
12T-0282 (CAS 860786-56-7), with molecular formula C23H20ClN3O2 and molecular weight 405.12 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]-5-methyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one.
Chemical Property Profile of 12T-0282
Property Insights of 12T-0282
The XLogP value of 4.62312 indicates that 12T-0282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.05 Ų, 12T-0282 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12T-0282 has 0 hydrogen bond donor(s) and 3 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 12T-0282?
The CAS number of 12T-0282 is 860786-56-7.
What is the molecular formula of 12T-0282?
The molecular formula of 12T-0282 is C23H20ClN3O2.
What is the molecular weight of 12T-0282?
The molecular weight of 12T-0282 is 405.12 g/mol.
Where can I buy 12T-0282?
You can request a quote for 12T-0282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12T-0282?
Yes, KEHONG BIO provides custom synthesis services for 12T-0282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.