BAS 00458931
TL;DR: BAS 00458931 (CAS 316360-01-7) is a chemical compound with molecular formula C19H17ClN2S2 and molecular weight 372.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-4,4,8-trimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
Also Known As: BAS 00458931, 2-(3-chlorophenyl)-4,4,8-trimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione, 2-(3-chlorophenyl)-4,4,8-trimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione, 2-(3-chlorophenyl)-4,4,8-trimethyl-2,4,5-trihydroisothiazolo[5,4-c]quinoline-1 -thione, 2-(3-chlorophenyl)-4,4,8-trimethyl-4,5-dihydro[1,2]thiazolo[5,4-c]quinoline-1(2H)-thione
| Molecular Formula | C19H17ClN2S2 |
|---|---|
| Molecular Weight | 372.05 g/mol |
| LogP | 6.55771 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 372.05215 |
| Heavy Atoms | 24 |
| Complexity | 1014.44653 |
Chemical Identifiers
| CAS Number | 316360-01-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(C3=C2C(=S)N(S3)C4=CC(=CC=C4)Cl)(C)C |
Product Overview
BAS 00458931 (CAS 316360-01-7), with molecular formula C19H17ClN2S2 and molecular weight 372.05 g/mol. IUPAC: 2-(3-chlorophenyl)-4,4,8-trimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione.
Chemical Property Profile of BAS 00458931
Property Insights of BAS 00458931
The XLogP value of 6.55771 indicates that BAS 00458931 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.96 Ų, BAS 00458931 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00458931 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00458931?
The CAS number of BAS 00458931 is 316360-01-7.
What is the molecular formula of BAS 00458931?
The molecular formula of BAS 00458931 is C19H17ClN2S2.
What is the molecular weight of BAS 00458931?
The molecular weight of BAS 00458931 is 372.05 g/mol.
Where can I buy BAS 00458931?
You can request a quote for BAS 00458931 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00458931?
Yes, KEHONG BIO provides custom synthesis services for BAS 00458931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.