ChemDiv1_010372
TL;DR: ChemDiv1_010372 (CAS 355428-91-0) is a chemical compound with molecular formula C21H16ClNO3S and molecular weight 397.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(2-oxo-2-thiophen-2-ylethyl)indol-2-one
Also Known As: ChemDiv1_010372, BAS 04200514, 1-(2-chlorobenzyl)-3-hydroxy-3-[2-oxo-2-(2-thienyl)ethyl]-1,3-dihydro-2H-indol-2-one, AB00120639-01, AN-655/40687903
| Molecular Formula | C21H16ClNO3S |
|---|---|
| Molecular Weight | 397.05 g/mol |
| LogP | 4.4089 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.05396 |
| Heavy Atoms | 27 |
| Complexity | 1017.7809 |
Chemical Identifiers
| CAS Number | 355428-91-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=CS4)O)Cl |
Product Overview
ChemDiv1_010372 (CAS 355428-91-0), with molecular formula C21H16ClNO3S and molecular weight 397.05 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(2-oxo-2-thiophen-2-ylethyl)indol-2-one.
Chemical Property Profile of ChemDiv1_010372
Property Insights of ChemDiv1_010372
The XLogP value of 4.4089 indicates that ChemDiv1_010372 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, ChemDiv1_010372 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_010372 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 ChemDiv1_010372?
The CAS number of ChemDiv1_010372 is 355428-91-0.
What is the molecular formula of ChemDiv1_010372?
The molecular formula of ChemDiv1_010372 is C21H16ClNO3S.
What is the molecular weight of ChemDiv1_010372?
The molecular weight of ChemDiv1_010372 is 397.05 g/mol.
Where can I buy ChemDiv1_010372?
You can request a quote for ChemDiv1_010372 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010372?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010372 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.