L 651580
TL;DR: L 651580 (CAS 103335-44-0) is a chemical compound with molecular formula C21H31NO3 and molecular weight 345.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxylate
Also Known As: methyl (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxylate, Methyl 3-oxo-4-methyl-4-aza-5alpha-androst-1-ene-17beta-carboxylate, methyl (4aR,4bS,6aS,7S,9aS,9bS,11aR)-1,4a,6a-trimethyl-2-oxo-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-indeno[5,4-f]quinoline-7-carboxylate, 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1,4a,6a-trimethyl-2-oxo-, methyl ester, (4aR,4bS,6aS,7S,9aS,9bS,11aR)-, 4-Methyl-3-oxo-4-aza-5alpha-androst-1-ene-17beta-carboxylic acid methyl ester
| Molecular Formula | C21H31NO3 |
|---|---|
| Molecular Weight | 345.23 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.2304 |
| Heavy Atoms | 25 |
| Complexity | 629.0 |
Chemical Identifiers
| CAS Number | 103335-44-0 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)OC)CC[C@@H]4[C@@]3(C=CC(=O)N4C)C |
| InChIKey | RYRGPLSUWGZYDE-ICVGDBTHSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
L 651580 (CAS 103335-44-0), with molecular formula C21H31NO3 and molecular weight 345.23 g/mol. IUPAC: methyl (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxylate.
Chemical Property Profile of L 651580
Property Insights of L 651580
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L 651580. With a topological polar surface area (TPSA) of 46.6 Ų, L 651580 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, L 651580 has 0 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 L 651580?
The CAS number of L 651580 is 103335-44-0.
What is the molecular formula of L 651580?
The molecular formula of L 651580 is C21H31NO3.
What is the molecular weight of L 651580?
The molecular weight of L 651580 is 345.23 g/mol.
Where can I buy L 651580?
You can request a quote for L 651580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L 651580?
Yes, KEHONG BIO provides custom synthesis services for L 651580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.