BAS 00836850
TL;DR: BAS 00836850 (CAS 302559-69-9) is a chemical compound with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-(2-oxo-1-pentylindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: BAS 00836850, 2-(2-oxo-1-pentyl-1,2-dihydro-3H-indol-3-ylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, AF-399/37112011, (2Z)-2-(2-oxo-1-pentylindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one, (Z)-2-(2-oxo-1-pentylindolin-3-ylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
| Molecular Formula | C22H19N3O2S |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 3.3639 |
| Topological Polar Surface Area | 54.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.1198 |
| Heavy Atoms | 28 |
| Complexity | 1335.0779 |
Chemical Identifiers
| CAS Number | 302559-69-9 |
|---|---|
| SMILES | CCCCCN1C2=CC=CC=C2/C(=C/3\C(=O)N4C5=CC=CC=C5N=C4S3)/C1=O |
Product Overview
BAS 00836850 (CAS 302559-69-9), with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol. IUPAC: (2Z)-2-(2-oxo-1-pentylindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of BAS 00836850
Property Insights of BAS 00836850
The XLogP value of 3.3639 indicates that BAS 00836850 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.68 Ų, BAS 00836850 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00836850 has 0 hydrogen bond donor(s) and 4 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 00836850?
The CAS number of BAS 00836850 is 302559-69-9.
What is the molecular formula of BAS 00836850?
The molecular formula of BAS 00836850 is C22H19N3O2S.
What is the molecular weight of BAS 00836850?
The molecular weight of BAS 00836850 is 389.12 g/mol.
Where can I buy BAS 00836850?
You can request a quote for BAS 00836850 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00836850?
Yes, KEHONG BIO provides custom synthesis services for BAS 00836850 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.