4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol
TL;DR: 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol (CAS 39837-89-3) is a chemical compound with molecular formula C18H30O2 and molecular weight 278.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]chromen-1-ol
Also Known As: KST-1A4552, 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol, 4,6-dimethyl-2-methylsulfonyl-1,3-pyrimidine, (4ar,4bs,6as,7s,9as,9bs,11ar)-4a,6a-dimethylhexadecahydroindeno[5,4-f]chromen-7-ol, (1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1,2,3,3a,3b,4,
| Molecular Formula | C18H30O2 |
|---|---|
| Molecular Weight | 278.22 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.22458 |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 39837-89-3 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@]3(CCCO4)C |
| InChIKey | JMNISNRAJNKYBE-KTSXYBPLSA-N |
Product Overview
4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol (CAS 39837-89-3), with molecular formula C18H30O2 and molecular weight 278.22 g/mol. IUPAC: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]chromen-1-ol.
Chemical Property Profile of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol
Property Insights of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol
The XLogP value of 3.7 indicates that 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol has 1 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 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol?
The CAS number of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol is 39837-89-3.
What is the molecular formula of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol?
The molecular formula of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol is C18H30O2.
What is the molecular weight of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol?
The molecular weight of 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol is 278.22 g/mol.
Where can I buy 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol?
You can request a quote for 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol?
Yes, KEHONG BIO provides custom synthesis services for 4a,6a-Dimethylhexadecahydroindeno(5,4-f)chromen-7-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.