氯利索克灵
TL;DR: 氯利索克灵 (CAS 148717-91-3) is a chemical compound with molecular formula C20H30ClNO4 and molecular weight 383.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯利索克灵
(3R)-3-[(1S)-2-[(1R,3S,4aS,7S,8aS)-7-chloro-3-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]pyrrolidine-2,5-dione
Also Known As: Chlorolissoclimide, (3R)-3-[(1S)-2-[(1R,3S,4aS,7S,8aS)-7-chloro-3-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]pyrrolidine-2,5-dione, 3-(2-(7-Chlorodecahydro-3-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl)-1-hydroxyethyl)-2,5-pyrrolidinedione, (3R)-3-((1S)-2-((1R,3S,4aS,7S,8aS)-7-chloro-3-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-1-hydroxyethyl)pyrrolidine-2,5-dione, (3R)-3-((1S)-2-((1R,3S,4aS,7S,8aS)-7-Chlorodecahydro-3-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl)-1-hydroxyethyl)-2,5-pyrrolidinedione
| Molecular Formula | C20H30ClNO4 |
|---|---|
| Molecular Weight | 383.19 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.18634 |
| Heavy Atoms | 26 |
| Complexity | 633.0 |
Chemical Identifiers
| CAS Number | 148717-91-3 |
|---|---|
| SMILES | C[C@]12C[C@H](CC([C@@H]1C[C@@H](C(=C)[C@@H]2C[C@@H]([C@H]3CC(=O)NC3=O)O)O)(C)C)Cl |
| InChIKey | LCBZIVZSFYGPBC-LWHFJPTFSA-N |
Product Overview
氯利索克灵 (CAS 148717-91-3), with molecular formula C20H30ClNO4 and molecular weight 383.19 g/mol. IUPAC: (3R)-3-[(1S)-2-[(1R,3S,4aS,7S,8aS)-7-chloro-3-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 氯利索克灵
Property Insights of 氯利索克灵
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯利索克灵. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 氯利索克灵. Following Lipinski's Rule of Five, 氯利索克灵 has 3 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 氯利索克灵?
The CAS number of 氯利索克灵 is 148717-91-3.
What is the molecular formula of 氯利索克灵?
The molecular formula of 氯利索克灵 is C20H30ClNO4.
What is the molecular weight of 氯利索克灵?
The molecular weight of 氯利索克灵 is 383.19 g/mol.
Where can I buy 氯利索克灵?
You can request a quote for 氯利索克灵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯利索克灵?
Yes, KEHONG BIO provides custom synthesis services for 氯利索克灵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.