3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one
TL;DR: 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one (CAS 136320-61-1) is a chemical compound with molecular formula C26H43NO2 and molecular weight 401.32938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,5S,9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one
Also Known As: 3-Hdceo, 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one, 24-(Dimethylamino)-3-hydroxychol-8(14)-en-15-one, 3EC-Hydroxy-24-dimethylamino-5I<<-chol-8(14)-en-15-one, (3S,5S,9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C26H43NO2 |
| Molecular Weight | 401.32938 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.32938 Da |
| Heavy Atoms | 29 |
| Complexity | 682.0 |
| SMILES | C[C@H](CCCN(C)C)[C@H]1CC(=O)C2=C3CC[C@H]4C[C@H](CC[C@@]4([C@H]3CC[C@]12C)C)O |
| InChIKey | RLFSWAJQOKQDTD-XVTIOWNMSA-N |
Chemical Property Profile of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one
Property Insights of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one
The XLogP value of 4.9 indicates that 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one 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
What is the CAS number of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one?
The CAS number of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one is 136320-61-1.
What is the molecular formula of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one?
The molecular formula of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one is C26H43NO2.
What is the molecular weight of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one?
The molecular weight of 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one is 401.32938 g/mol.
Where can I buy 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one?
You can request a quote for 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one?
Yes, CoreyChem provides custom synthesis services for 3-Hydroxy-24-dimethylaminochol-8(14)-en-15-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.