INOCOTERONE
TL;DR: INOCOTERONE (CAS 83646-97-3) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-3-hydroxy-3a-methyl-2,3,4,5,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-7-one
Also Known As: INOCOTERONE, 1,2,3,3a,4,5,8,9,9a,9b-Decahydro-6-ethyl-3-hydroxy-3a-methyl-7H-benz(e)inden-7-one, 7H-Benz(e)inden-7-one, 1,2,3,3a,4,5,8,9,9a,9b-decahydro-6-ethyl-3-hydroxy-3a-methyl-, 6-ethyl-3-hydroxy-3a-methyl-2,3,4,5,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-7-one, 6-Ethyl-3-hydroxy-3a-methyl-1,2,3,3a,4,5,8,9,9a,9b-decahydro-7H-cyclopenta[a]naphthalen-7-one
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 3.2431 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 409.32004 |
Chemical Identifiers
| CAS Number | 83646-97-3 |
|---|---|
| SMILES | CCC1=C2CCC3(C(C2CCC1=O)CCC3O)C |
Product Overview
INOCOTERONE (CAS 83646-97-3), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: 6-ethyl-3-hydroxy-3a-methyl-2,3,4,5,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-7-one.
Chemical Property Profile of INOCOTERONE
Property Insights of INOCOTERONE
The XLogP value of 3.2431 indicates that INOCOTERONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, INOCOTERONE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, INOCOTERONE 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 INOCOTERONE?
The CAS number of INOCOTERONE is 83646-97-3.
What is the molecular formula of INOCOTERONE?
The molecular formula of INOCOTERONE is C16H24O2.
What is the molecular weight of INOCOTERONE?
The molecular weight of INOCOTERONE is 248.18 g/mol.
Where can I buy INOCOTERONE?
You can request a quote for INOCOTERONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for INOCOTERONE?
Yes, KEHONG BIO provides custom synthesis services for INOCOTERONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.