A3435/0145763
TL;DR: A3435/0145763 (CAS 693268-30-3) is a chemical compound with molecular formula C21H17N3OS and molecular weight 359.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(E)-2-(3-methylthiophen-2-yl)ethenyl]-2-phenyl-1,2,4-triazol-3-yl]phenol
Also Known As: A3435/0145763, (E)-2-(3-(2-(3-methylthiophen-2-yl)vinyl)-1-phenyl-1H-1,2,4-triazol-5-yl)phenol, 2-{3-[(E)-2-(3-methylthiophen-2-yl)ethenyl]-1-phenyl-1H-1,2,4-triazol-5-yl}phenol, (6E)-6-[5-[(E)-2-(3-methylthiophen-2-yl)ethenyl]-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one, 2-{3-[(1E)-2-(3-METHYLTHIOPHEN-2-YL)ETHENYL]-1-PHENYL-1H-1,2,4-TRIAZOL-5-YL}PHENOL
| Molecular Formula | C21H17N3OS |
|---|---|
| Molecular Weight | 359.11 g/mol |
| LogP | 5.18022 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.10922 |
| Heavy Atoms | 26 |
| Complexity | 1063.8219 |
Chemical Identifiers
| CAS Number | 693268-30-3 |
|---|---|
| SMILES | CC1=C(SC=C1)/C=C/C2=NN(C(=N2)C3=CC=CC=C3O)C4=CC=CC=C4 |
Product Overview
A3435/0145763 (CAS 693268-30-3), with molecular formula C21H17N3OS and molecular weight 359.11 g/mol. IUPAC: 2-[5-[(E)-2-(3-methylthiophen-2-yl)ethenyl]-2-phenyl-1,2,4-triazol-3-yl]phenol.
Chemical Property Profile of A3435/0145763
Property Insights of A3435/0145763
The XLogP value of 5.18022 indicates that A3435/0145763 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, A3435/0145763 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3435/0145763 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 A3435/0145763?
The CAS number of A3435/0145763 is 693268-30-3.
What is the molecular formula of A3435/0145763?
The molecular formula of A3435/0145763 is C21H17N3OS.
What is the molecular weight of A3435/0145763?
The molecular weight of A3435/0145763 is 359.11 g/mol.
Where can I buy A3435/0145763?
You can request a quote for A3435/0145763 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3435/0145763?
Yes, KEHONG BIO provides custom synthesis services for A3435/0145763 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.