(S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one
TL;DR: (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one (CAS 147244-91-5) is a chemical compound with molecular formula C9H9ClN2O and molecular weight 196.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-6-chloro-3-methyl-3,4-dihydro-1H-quinoxalin-2-one
Also Known As: (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one, 6-chloro-3-methyl-3,4-dihydro-1H-quinoxalin-2-one, 6-chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one
| Molecular Formula | C9H9ClN2O |
|---|---|
| Molecular Weight | 196.04 g/mol |
| LogP | 2.0925 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.04034 |
| Heavy Atoms | 13 |
| Complexity | 364.6324 |
Chemical Identifiers
| CAS Number | 147244-91-5 |
|---|---|
| SMILES | C[C@H]1C(=O)NC2=C(N1)C=C(C=C2)Cl |
Product Overview
(S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one (CAS 147244-91-5), with molecular formula C9H9ClN2O and molecular weight 196.04 g/mol. IUPAC: (3S)-6-chloro-3-methyl-3,4-dihydro-1H-quinoxalin-2-one.
Chemical Property Profile of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one
Property Insights of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one
The XLogP value of 2.0925 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one. With a topological polar surface area (TPSA) of 41.13 Ų, (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one has 2 hydrogen bond donor(s) and 2 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 (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one?
The CAS number of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one is 147244-91-5.
What is the molecular formula of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one?
The molecular formula of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one is C9H9ClN2O.
What is the molecular weight of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one?
The molecular weight of (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one is 196.04 g/mol.
Where can I buy (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one?
You can request a quote for (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for (S)-6-Chloro-3-methyl-3,4-dihydroquinoxalin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.