CAS 374545-25-2 - C21H18ClN3OS
TL;DR: CAS 374545-25-2 - C21H18ClN3OS (CAS 374545-25-2) is a chemical compound with molecular formula C21H18ClN3OS and molecular weight 395.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-chloro-2-methylanilino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: (2Z)-3-[(3-chloro-2-methylphenyl)amino]-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C21H18ClN3OS |
|---|---|
| Molecular Weight | 395.09 g/mol |
| LogP | 6.1472 |
| Topological Polar Surface Area | 57.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.0859 |
| Heavy Atoms | 27 |
| Complexity | 1003.01135 |
Chemical Identifiers
| CAS Number | 374545-25-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=CSC(=N2)/C(=C/NC3=C(C(=CC=C3)Cl)C)/C#N |
Product Overview
CAS 374545-25-2 - C21H18ClN3OS (CAS 374545-25-2), with molecular formula C21H18ClN3OS and molecular weight 395.09 g/mol. IUPAC: (E)-3-(3-chloro-2-methylanilino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of CAS 374545-25-2 - C21H18ClN3OS
Property Insights of CAS 374545-25-2 - C21H18ClN3OS
The XLogP value of 6.1472 indicates that CAS 374545-25-2 - C21H18ClN3OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.94 Ų, CAS 374545-25-2 - C21H18ClN3OS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CAS 374545-25-2 - C21H18ClN3OS 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 CAS 374545-25-2 - C21H18ClN3OS?
The CAS number of CAS 374545-25-2 - C21H18ClN3OS is 374545-25-2.
What is the molecular formula of CAS 374545-25-2 - C21H18ClN3OS?
The molecular formula of CAS 374545-25-2 - C21H18ClN3OS is C21H18ClN3OS.
What is the molecular weight of CAS 374545-25-2 - C21H18ClN3OS?
The molecular weight of CAS 374545-25-2 - C21H18ClN3OS is 395.09 g/mol.
Where can I buy CAS 374545-25-2 - C21H18ClN3OS?
You can request a quote for CAS 374545-25-2 - C21H18ClN3OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 374545-25-2 - C21H18ClN3OS?
Yes, KEHONG BIO provides custom synthesis services for CAS 374545-25-2 - C21H18ClN3OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.