A1411/0063103
TL;DR: A1411/0063103 (CAS 311775-67-4) is a chemical compound with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: A1411/0063103, N-(4-methoxyphenyl)-2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-methoxyphenyl)acetamide, N-(4-methoxyphenyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C21H22N4O3S |
|---|---|
| Molecular Weight | 410.14 g/mol |
| LogP | 3.8791 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 410.14127 |
| Heavy Atoms | 29 |
| Complexity | 968.5962 |
Chemical Identifiers
| CAS Number | 311775-67-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)OC |
Product Overview
A1411/0063103 (CAS 311775-67-4), with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol. IUPAC: N-(4-methoxyphenyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of A1411/0063103
Property Insights of A1411/0063103
The XLogP value of 3.8791 indicates that A1411/0063103 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for A1411/0063103. Following Lipinski's Rule of Five, A1411/0063103 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 A1411/0063103?
The CAS number of A1411/0063103 is 311775-67-4.
What is the molecular formula of A1411/0063103?
The molecular formula of A1411/0063103 is C21H22N4O3S.
What is the molecular weight of A1411/0063103?
The molecular weight of A1411/0063103 is 410.14 g/mol.
Where can I buy A1411/0063103?
You can request a quote for A1411/0063103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1411/0063103?
Yes, KEHONG BIO provides custom synthesis services for A1411/0063103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.