AB00075836-01
TL;DR: AB00075836-01 (CAS 378199-83-8) is a chemical compound with molecular formula C11H4Br2N2O2S2 and molecular weight 417.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dibromo-3-(4-hydroxy-2-sulfanylidene-3H-1,3-thiazol-5-yl)indol-2-one
Also Known As: AB00075836-01, (5Z)-5-(5,7-dibromo-2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-(5,7-dibromo-2-oxoindolin-3-ylidene)-2-thioxothiazolidin-4-one, 5,7-dibromo-3-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1H-indol-2-one, 5-(5,7-dibromo-2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C11H4Br2N2O2S2 |
|---|---|
| Molecular Weight | 417.81 g/mol |
| LogP | 2.39509 |
| Topological Polar Surface Area | 65.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 417.80807 |
| Heavy Atoms | 19 |
| Complexity | 898.3946 |
Chemical Identifiers
| CAS Number | 378199-83-8 |
|---|---|
| SMILES | C1=C(C=C(C2=NC(=O)C(=C21)C3=C(NC(=S)S3)O)Br)Br |
Product Overview
AB00075836-01 (CAS 378199-83-8), with molecular formula C11H4Br2N2O2S2 and molecular weight 417.81 g/mol. IUPAC: 5,7-dibromo-3-(4-hydroxy-2-sulfanylidene-3H-1,3-thiazol-5-yl)indol-2-one.
Chemical Property Profile of AB00075836-01
Property Insights of AB00075836-01
The XLogP value of 2.39509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00075836-01. The TPSA of 65.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00075836-01. Following Lipinski's Rule of Five, AB00075836-01 has 2 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 AB00075836-01?
The CAS number of AB00075836-01 is 378199-83-8.
What is the molecular formula of AB00075836-01?
The molecular formula of AB00075836-01 is C11H4Br2N2O2S2.
What is the molecular weight of AB00075836-01?
The molecular weight of AB00075836-01 is 417.81 g/mol.
Where can I buy AB00075836-01?
You can request a quote for AB00075836-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00075836-01?
Yes, KEHONG BIO provides custom synthesis services for AB00075836-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.