F1563-0045
TL;DR: F1563-0045 (CAS 325992-98-1) is a chemical compound with molecular formula C22H18N4S3 and molecular weight 434.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-3-[4-(dimethylamino)phenyl]prop-2-enenitrile
Also Known As: F1563-0045, (2E)-2-{4-[(1,3-BENZOTHIAZOL-2-YLSULFANYL)METHYL]-1,3-THIAZOL-2-YL}-3-[4-(DIMETHYLAMINO)PHENYL]PROP-2-ENENITRILE, (E)-2-(4-((benzo[d]thiazol-2-ylthio)methyl)thiazol-2-yl)-3-(4-(dimethylamino)phenyl)acrylonitrile, (E)-2-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-3-(4-dimethylaminophenyl)prop-2-enenitrile, (E)-2-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-3-[4-(dimethylamino)phenyl]prop-2-enenitrile
| Molecular Formula | C22H18N4S3 |
|---|---|
| Molecular Weight | 434.07 g/mol |
| LogP | 6.17528 |
| Topological Polar Surface Area | 52.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.06937 |
| Heavy Atoms | 29 |
| Complexity | 1163.7584 |
Chemical Identifiers
| CAS Number | 325992-98-1 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=CS2)CSC3=NC4=CC=CC=C4S3 |
Product Overview
F1563-0045 (CAS 325992-98-1), with molecular formula C22H18N4S3 and molecular weight 434.07 g/mol. IUPAC: (E)-2-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-3-[4-(dimethylamino)phenyl]prop-2-enenitrile.
Chemical Property Profile of F1563-0045
Property Insights of F1563-0045
The XLogP value of 6.17528 indicates that F1563-0045 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.81 Ų, F1563-0045 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1563-0045 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1563-0045?
The CAS number of F1563-0045 is 325992-98-1.
What is the molecular formula of F1563-0045?
The molecular formula of F1563-0045 is C22H18N4S3.
What is the molecular weight of F1563-0045?
The molecular weight of F1563-0045 is 434.07 g/mol.
Where can I buy F1563-0045?
You can request a quote for F1563-0045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1563-0045?
Yes, KEHONG BIO provides custom synthesis services for F1563-0045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.