BAS 00865674
TL;DR: BAS 00865674 (CAS 332045-99-5) is a chemical compound with molecular formula C22H13ClN2OS and molecular weight 388.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(5-phenylfuran-2-yl)prop-2-enenitrile
Also Known As: BAS 00865674, (2E)-2-[4-(4-chlorophenyl)(1,3-thiazol-2-yl)]-3-(5-phenyl(2-furyl))prop-2-enen itrile, (2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(5-phenylfuran-2-yl)prop-2-enenitrile, (E)-2-(4-(4-chlorophenyl)thiazol-2-yl)-3-(5-phenylfuran-2-yl)acrylonitrile, (E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(5-phenylfuran-2-yl)prop-2-enenitrile
| Molecular Formula | C22H13ClN2OS |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 6.78768 |
| Topological Polar Surface Area | 49.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.0437 |
| Heavy Atoms | 27 |
| Complexity | 1135.0369 |
Chemical Identifiers
| CAS Number | 332045-99-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC(=CS3)C4=CC=C(C=C4)Cl |
Product Overview
BAS 00865674 (CAS 332045-99-5), with molecular formula C22H13ClN2OS and molecular weight 388.04 g/mol. IUPAC: (E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(5-phenylfuran-2-yl)prop-2-enenitrile.
Chemical Property Profile of BAS 00865674
Property Insights of BAS 00865674
The XLogP value of 6.78768 indicates that BAS 00865674 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.82 Ų, BAS 00865674 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00865674 has 0 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 BAS 00865674?
The CAS number of BAS 00865674 is 332045-99-5.
What is the molecular formula of BAS 00865674?
The molecular formula of BAS 00865674 is C22H13ClN2OS.
What is the molecular weight of BAS 00865674?
The molecular weight of BAS 00865674 is 388.04 g/mol.
Where can I buy BAS 00865674?
You can request a quote for BAS 00865674 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00865674?
Yes, KEHONG BIO provides custom synthesis services for BAS 00865674 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.