BAS 09535870
TL;DR: BAS 09535870 (CAS 5189-93-5) is a chemical compound with molecular formula C21H23N3O3S and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 09535870, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide, N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide, N-(5,5-DIMETHYL-7-OXO-4,6-DIHYDROBENZOTHIAZOL-2-YL)-1-(4-METHYLPHENYL)-5-OXO-PYRROLIDINE-3-CARBOXAMIDE
| Molecular Formula | C21H23N3O3S |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 3.59822 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.14603 |
| Heavy Atoms | 28 |
| Complexity | 961.77545 |
Chemical Identifiers
| CAS Number | 5189-93-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C(=O)CC(C4)(C)C |
Product Overview
BAS 09535870 (CAS 5189-93-5), with molecular formula C21H23N3O3S and molecular weight 397.15 g/mol. IUPAC: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 09535870
Property Insights of BAS 09535870
The XLogP value of 3.59822 indicates that BAS 09535870 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09535870. Following Lipinski's Rule of Five, BAS 09535870 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 09535870?
The CAS number of BAS 09535870 is 5189-93-5.
What is the molecular formula of BAS 09535870?
The molecular formula of BAS 09535870 is C21H23N3O3S.
What is the molecular weight of BAS 09535870?
The molecular weight of BAS 09535870 is 397.15 g/mol.
Where can I buy BAS 09535870?
You can request a quote for BAS 09535870 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09535870?
Yes, KEHONG BIO provides custom synthesis services for BAS 09535870 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.