BIM-0039246.P001
TL;DR: BIM-0039246.P001 (CAS 423741-27-9) is a chemical compound with molecular formula C18H11ClN2O2S2 and molecular weight 386.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-benzyl-4-hydroxy-2-sulfanylidene-1,3-thiazol-5-yl)-5-chloroindol-2-one
Also Known As: BIM-0039246.P001, AB00101733-01, 3-benzyl-5-(5-chloro-2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-3-benzyl-5-(5-chloro-2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one, 3-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-5-chloro-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C18H11ClN2O2S2 |
|---|---|
| Molecular Weight | 386.00 g/mol |
| LogP | 3.04519 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.99506 |
| Heavy Atoms | 25 |
| Complexity | 1180.0205 |
Chemical Identifiers
| CAS Number | 423741-27-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(SC2=S)C3=C4C=C(C=CC4=NC3=O)Cl)O |
Product Overview
BIM-0039246.P001 (CAS 423741-27-9), with molecular formula C18H11ClN2O2S2 and molecular weight 386.00 g/mol. IUPAC: 3-(3-benzyl-4-hydroxy-2-sulfanylidene-1,3-thiazol-5-yl)-5-chloroindol-2-one.
Chemical Property Profile of BIM-0039246.P001
Property Insights of BIM-0039246.P001
The XLogP value of 3.04519 indicates that BIM-0039246.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, BIM-0039246.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0039246.P001 has 1 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 BIM-0039246.P001?
The CAS number of BIM-0039246.P001 is 423741-27-9.
What is the molecular formula of BIM-0039246.P001?
The molecular formula of BIM-0039246.P001 is C18H11ClN2O2S2.
What is the molecular weight of BIM-0039246.P001?
The molecular weight of BIM-0039246.P001 is 386.00 g/mol.
Where can I buy BIM-0039246.P001?
You can request a quote for BIM-0039246.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0039246.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0039246.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.