A1683/0071827
TL;DR: A1683/0071827 (CAS 312265-56-8) is a chemical compound with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
Also Known As: A1683/0071827, 2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenyl-1-ethanone, 2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one, 2-((4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-1-phenylethanone, 2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
| Molecular Formula | C20H19N3O2S |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 4.1147 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 365.1198 |
| Heavy Atoms | 26 |
| Complexity | 889.17957 |
Chemical Identifiers
| CAS Number | 312265-56-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)C3=CC=CC=C3 |
Product Overview
A1683/0071827 (CAS 312265-56-8), with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol. IUPAC: 2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone.
Chemical Property Profile of A1683/0071827
Property Insights of A1683/0071827
The XLogP value of 4.1147 indicates that A1683/0071827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, A1683/0071827 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A1683/0071827 has 0 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 A1683/0071827?
The CAS number of A1683/0071827 is 312265-56-8.
What is the molecular formula of A1683/0071827?
The molecular formula of A1683/0071827 is C20H19N3O2S.
What is the molecular weight of A1683/0071827?
The molecular weight of A1683/0071827 is 365.12 g/mol.
Where can I buy A1683/0071827?
You can request a quote for A1683/0071827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1683/0071827?
Yes, KEHONG BIO provides custom synthesis services for A1683/0071827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.