BAS 00372770
TL;DR: BAS 00372770 (CAS 331272-86-7) is a chemical compound with molecular formula C21H19Cl2F3N2O3S and molecular weight 506.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]butyl N-[3-(trifluoromethyl)phenyl]carbamate
Also Known As: BAS 00372770, 2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]butyl 3-(trifluoromethyl)phenylcarbamate, 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)butyl (3-(trifluoromethyl)phenyl)carbamate, 2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]butyl N-[3-(trifluoromethyl)phenyl]carbamate, 2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]butyl [3-(trifluoromethyl)phenyl]carbamate
| Molecular Formula | C21H19Cl2F3N2O3S |
|---|---|
| Molecular Weight | 506.04 g/mol |
| LogP | 6.6135 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.04456 |
| Heavy Atoms | 32 |
| Complexity | 1006.4954 |
Chemical Identifiers
| CAS Number | 331272-86-7 |
|---|---|
| SMILES | CCC(COC(=O)NC1=CC=CC(=C1)C(F)(F)F)N2C(SCC2=O)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
BAS 00372770 (CAS 331272-86-7), with molecular formula C21H19Cl2F3N2O3S and molecular weight 506.04 g/mol. IUPAC: 2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]butyl N-[3-(trifluoromethyl)phenyl]carbamate.
Chemical Property Profile of BAS 00372770
Property Insights of BAS 00372770
The XLogP value of 6.6135 indicates that BAS 00372770 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 00372770 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00372770 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 BAS 00372770?
The CAS number of BAS 00372770 is 331272-86-7.
What is the molecular formula of BAS 00372770?
The molecular formula of BAS 00372770 is C21H19Cl2F3N2O3S.
What is the molecular weight of BAS 00372770?
The molecular weight of BAS 00372770 is 506.04 g/mol.
Where can I buy BAS 00372770?
You can request a quote for BAS 00372770 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00372770?
Yes, KEHONG BIO provides custom synthesis services for BAS 00372770 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.