BAS 00836852
TL;DR: BAS 00836852 (CAS 304893-29-6) is a chemical compound with molecular formula C24H23N3O2S and molecular weight 417.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-(1-heptyl-2-oxoindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: BAS 00836852, 2-(1-heptyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, AF-399/37112012, (2Z)-2-(1-heptyl-2-oxoindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one, (Z)-2-(1-heptyl-2-oxoindolin-3-ylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
| Molecular Formula | C24H23N3O2S |
|---|---|
| Molecular Weight | 417.15 g/mol |
| LogP | 4.1441 |
| Topological Polar Surface Area | 54.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.1511 |
| Heavy Atoms | 30 |
| Complexity | 1368.3748 |
Chemical Identifiers
| CAS Number | 304893-29-6 |
|---|---|
| SMILES | CCCCCCCN1C2=CC=CC=C2/C(=C/3\C(=O)N4C5=CC=CC=C5N=C4S3)/C1=O |
Product Overview
BAS 00836852 (CAS 304893-29-6), with molecular formula C24H23N3O2S and molecular weight 417.15 g/mol. IUPAC: (2Z)-2-(1-heptyl-2-oxoindol-3-ylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of BAS 00836852
Property Insights of BAS 00836852
The XLogP value of 4.1441 indicates that BAS 00836852 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 00836852 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00836852 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 00836852?
The CAS number of BAS 00836852 is 304893-29-6.
What is the molecular formula of BAS 00836852?
The molecular formula of BAS 00836852 is C24H23N3O2S.
What is the molecular weight of BAS 00836852?
The molecular weight of BAS 00836852 is 417.15 g/mol.
Where can I buy BAS 00836852?
You can request a quote for BAS 00836852 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00836852?
Yes, KEHONG BIO provides custom synthesis services for BAS 00836852 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.