BAS 05331200
TL;DR: BAS 05331200 (CAS 692272-80-3) is a chemical compound with molecular formula C18H16ClNO3 and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-hydroxy-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]indol-2-one
Also Known As: BAS 05331200, 5-chloro-3-hydroxy-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one, 5-chloro-3-hydroxy-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]indol-2-one, 5-Chloro-3-hydroxy-1-methyl-3-(2-oxo-2-p-tolyl-ethyl)-1,3-dihydro-indol-2-one, 5-chloro-3-hydroxy-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]indolin-2-one
| Molecular Formula | C18H16ClNO3 |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.08542 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.08188 |
| Heavy Atoms | 23 |
| Complexity | 800.41406 |
Chemical Identifiers
| CAS Number | 692272-80-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Cl)N(C2=O)C)O |
Product Overview
BAS 05331200 (CAS 692272-80-3), with molecular formula C18H16ClNO3 and molecular weight 329.08 g/mol. IUPAC: 5-chloro-3-hydroxy-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]indol-2-one.
Chemical Property Profile of BAS 05331200
Property Insights of BAS 05331200
The XLogP value of 3.08542 indicates that BAS 05331200 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, BAS 05331200 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 05331200 has 1 hydrogen bond donor(s) and 3 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 05331200?
The CAS number of BAS 05331200 is 692272-80-3.
What is the molecular formula of BAS 05331200?
The molecular formula of BAS 05331200 is C18H16ClNO3.
What is the molecular weight of BAS 05331200?
The molecular weight of BAS 05331200 is 329.08 g/mol.
Where can I buy BAS 05331200?
You can request a quote for BAS 05331200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05331200?
Yes, KEHONG BIO provides custom synthesis services for BAS 05331200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.