A1542/0067103
TL;DR: A1542/0067103 (CAS 311792-63-9) is a chemical compound with molecular formula C29H32N4OS and molecular weight 484.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzhydryl-2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide
Also Known As: A1542/0067103, N-benzhydryl-2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide, 2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(diphenylmethyl)propanamide, N-benzhydryl-2-((5-(4-(tert-butyl)phenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)propanamide, N-benzhydryl-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide
| Molecular Formula | C29H32N4OS |
|---|---|
| Molecular Weight | 484.23 g/mol |
| LogP | 6.166 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.22968 |
| Heavy Atoms | 35 |
| Complexity | 1222.297 |
Chemical Identifiers
| CAS Number | 311792-63-9 |
|---|---|
| SMILES | CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NN=C(N3C)C4=CC=C(C=C4)C(C)(C)C |
Product Overview
A1542/0067103 (CAS 311792-63-9), with molecular formula C29H32N4OS and molecular weight 484.23 g/mol. IUPAC: N-benzhydryl-2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide.
Chemical Property Profile of A1542/0067103
Property Insights of A1542/0067103
The XLogP value of 6.166 indicates that A1542/0067103 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, A1542/0067103 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A1542/0067103 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1542/0067103?
The CAS number of A1542/0067103 is 311792-63-9.
What is the molecular formula of A1542/0067103?
The molecular formula of A1542/0067103 is C29H32N4OS.
What is the molecular weight of A1542/0067103?
The molecular weight of A1542/0067103 is 484.23 g/mol.
Where can I buy A1542/0067103?
You can request a quote for A1542/0067103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1542/0067103?
Yes, KEHONG BIO provides custom synthesis services for A1542/0067103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.