(11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione
TL;DR: (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione (CAS 1212466-99-3) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione
Also Known As: (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione, (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquinolino[2,1-a]quinoline-1,13(2H)-dione, (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione
| Molecular Formula | C18H19NO2 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 2.8117 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 281.14157 |
| Heavy Atoms | 21 |
| Complexity | 673.55084 |
Chemical Identifiers
| CAS Number | 1212466-99-3 |
|---|---|
| SMILES | C[C@H]1[C@H]2C3=CC=CC=C3CCN2C4=C(C1=O)C(=O)CCC4 |
Product Overview
(11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione (CAS 1212466-99-3), with molecular formula C18H19NO2 and molecular weight 281.14 g/mol. IUPAC: (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione.
Chemical Property Profile of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione
Property Insights of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione
The XLogP value of 2.8117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione. With a topological polar surface area (TPSA) of 37.38 Ų, (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione 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 (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione?
The CAS number of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione is 1212466-99-3.
What is the molecular formula of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione?
The molecular formula of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione is C18H19NO2.
What is the molecular weight of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione?
The molecular weight of (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione is 281.14 g/mol.
Where can I buy (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione?
You can request a quote for (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (11bS,12S)-12-methyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.