BAS 02590430
TL;DR: BAS 02590430 (CAS 333414-65-6) is a chemical compound with molecular formula C20H16FN3OS and molecular weight 365.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-(3-fluoro-4-methylanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: BAS 02590430, (Z)-3-((3-fluoro-4-methylphenyl)amino)-2-(4-(4-methoxyphenyl)thiazol-2-yl)acrylonitrile, (Z)-3-(3-fluoro-4-methylanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C20H16FN3OS |
|---|---|
| Molecular Weight | 365.10 g/mol |
| LogP | 5.2428 |
| Topological Polar Surface Area | 57.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.09982 |
| Heavy Atoms | 26 |
| Complexity | 987.0361 |
Chemical Identifiers
| CAS Number | 333414-65-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC=C(C=C3)OC)F |
Product Overview
BAS 02590430 (CAS 333414-65-6), with molecular formula C20H16FN3OS and molecular weight 365.10 g/mol. IUPAC: (Z)-3-(3-fluoro-4-methylanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of BAS 02590430
Property Insights of BAS 02590430
The XLogP value of 5.2428 indicates that BAS 02590430 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.94 Ų, BAS 02590430 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02590430 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02590430?
The CAS number of BAS 02590430 is 333414-65-6.
What is the molecular formula of BAS 02590430?
The molecular formula of BAS 02590430 is C20H16FN3OS.
What is the molecular weight of BAS 02590430?
The molecular weight of BAS 02590430 is 365.10 g/mol.
Where can I buy BAS 02590430?
You can request a quote for BAS 02590430 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02590430?
Yes, KEHONG BIO provides custom synthesis services for BAS 02590430 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.