17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one
TL;DR: 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one (CAS 567-72-6) is a chemical compound with molecular formula C27H42O and molecular weight 382.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-one
Also Known As: CHOLESTA-3,5-DIEN-7-ONE, 3,5-Cholestadien-7-one, .DELTA.3,5-Cholestadien-7-one, AI3-52863, 17-(DIMETHYL-HEXYL)-10,13-DIMETHYL-DODECAHYDRO-CYCLOPENTA(A)PHENANTHREN-7-ONE
| Molecular Formula | C27H42O |
|---|---|
| Molecular Weight | 382.32 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.32358 |
| Heavy Atoms | 28 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 567-72-6 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2C(=O)C=C4C3(CCC=C4)C)C |
| InChIKey | TTXJJFWWNDJDNR-UHFFFAOYSA-N |
Product Overview
17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one (CAS 567-72-6), with molecular formula C27H42O and molecular weight 382.32 g/mol. IUPAC: 10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-one.
Chemical Property Profile of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one
Property Insights of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one
The XLogP value of 8.7 indicates that 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one?
The CAS number of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one is 567-72-6.
What is the molecular formula of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one?
The molecular formula of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one is C27H42O.
What is the molecular weight of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one?
The molecular weight of 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one is 382.32 g/mol.
Where can I buy 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one?
You can request a quote for 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one?
Yes, KEHONG BIO provides custom synthesis services for 17-(Dimethyl-hexyl)-10,13-dimethyl-dodecahydro-cyclopenta(A)phenanthren-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.