AB00096159-01
TL;DR: AB00096159-01 (CAS 301691-80-5) is a chemical compound with molecular formula C19H13N3O3S2 and molecular weight 395.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]-2-methylbenzamide
Also Known As: AB00096159-01, 2-methyl-N-[(5Z)-4-oxo-5-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide, (Z)-2-methyl-N-(4-oxo-5-(2-oxoindolin-3-ylidene)-2-thioxothiazolidin-3-yl)benzamide, (2-methylphenyl)-N-[4-oxo-5-(2-oxo(1H-benzo[d]azolin-3-ylidene))-2-thioxo(1,3- thiazolidin-3-yl)]carboxamide, 2-methyl-N-[(5E)-4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C19H13N3O3S2 |
|---|---|
| Molecular Weight | 395.04 g/mol |
| LogP | 2.03581 |
| Topological Polar Surface Area | 83.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.03983 |
| Heavy Atoms | 27 |
| Complexity | 1288.014 |
Chemical Identifiers
| CAS Number | 301691-80-5 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NN2C(=C(SC2=S)C3=C4C=CC=CC4=NC3=O)O |
Product Overview
AB00096159-01 (CAS 301691-80-5), with molecular formula C19H13N3O3S2 and molecular weight 395.04 g/mol. IUPAC: N-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]-2-methylbenzamide.
Chemical Property Profile of AB00096159-01
Property Insights of AB00096159-01
The XLogP value of 2.03581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00096159-01. The TPSA of 83.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00096159-01. Following Lipinski's Rule of Five, AB00096159-01 has 2 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 AB00096159-01?
The CAS number of AB00096159-01 is 301691-80-5.
What is the molecular formula of AB00096159-01?
The molecular formula of AB00096159-01 is C19H13N3O3S2.
What is the molecular weight of AB00096159-01?
The molecular weight of AB00096159-01 is 395.04 g/mol.
Where can I buy AB00096159-01?
You can request a quote for AB00096159-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00096159-01?
Yes, KEHONG BIO provides custom synthesis services for AB00096159-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.