BAS 00556170
TL;DR: BAS 00556170 (CAS 305376-96-9) is a chemical compound with molecular formula C18H12N2O2S2 and molecular weight 352.03 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)indol-2-one
Also Known As: BAS 00556170, AF-399/32479044, (3Z)-3-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-dihydro-2H-indol-2-one, (Z)-3-benzyl-5-(2-oxoindolin-3-ylidene)-2-thioxothiazolidin-4-one, (5E)-3-benzyl-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H12N2O2S2 |
|---|---|
| Molecular Weight | 352.03 g/mol |
| LogP | 2.39179 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.03403 |
| Heavy Atoms | 24 |
| Complexity | 1127.8157 |
Chemical Identifiers
| CAS Number | 305376-96-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(SC2=S)C3=C4C=CC=CC4=NC3=O)O |
Product Overview
BAS 00556170 (CAS 305376-96-9), with molecular formula C18H12N2O2S2 and molecular weight 352.03 g/mol. IUPAC: 3-(3-benzyl-4-hydroxy-2-sulfanylidene-1,3-thiazol-5-yl)indol-2-one.
Chemical Property Profile of BAS 00556170
Property Insights of BAS 00556170
The XLogP value of 2.39179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00556170. With a topological polar surface area (TPSA) of 54.59 Ų, BAS 00556170 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00556170 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 BAS 00556170?
The CAS number of BAS 00556170 is 305376-96-9.
What is the molecular formula of BAS 00556170?
The molecular formula of BAS 00556170 is C18H12N2O2S2.
What is the molecular weight of BAS 00556170?
The molecular weight of BAS 00556170 is 352.03 g/mol.
Where can I buy BAS 00556170?
You can request a quote for BAS 00556170 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00556170?
Yes, KEHONG BIO provides custom synthesis services for BAS 00556170 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.