17-beta-Cinnamoylandrost-4-en-3-one
TL;DR: 17-beta-Cinnamoylandrost-4-en-3-one (CAS 103281-82-9) is a chemical compound with molecular formula C28H34O2 and molecular weight 402.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(E)-3-phenylprop-2-enoyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 17-beta-Cinnamoylandrost-4-en-3-one, 17beta-Cinnamoylandrost-4-en-3-one, ANDROST-4-EN-3-ONE, 17-beta-CINNAMOYL-, 3-07-00-04243 (Beilstein Handbook Reference), (1S,3aS,3bS,9aR,9bS,11aS)-9a,11a-dimethyl-1-[(2E)-3-phenylprop-2-enoyl]-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
| Molecular Formula | C28H34O2 |
|---|---|
| Molecular Weight | 402.26 g/mol |
| LogP | 6.417 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.2559 |
| Heavy Atoms | 30 |
| Complexity | 909.8266 |
Chemical Identifiers
| CAS Number | 103281-82-9 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)/C=C/C4=CC=CC=C4)CCC5=CC(=O)CC[C@]35C |
Product Overview
17-beta-Cinnamoylandrost-4-en-3-one (CAS 103281-82-9), with molecular formula C28H34O2 and molecular weight 402.26 g/mol. IUPAC: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(E)-3-phenylprop-2-enoyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 17-beta-Cinnamoylandrost-4-en-3-one
Property Insights of 17-beta-Cinnamoylandrost-4-en-3-one
The XLogP value of 6.417 indicates that 17-beta-Cinnamoylandrost-4-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 17-beta-Cinnamoylandrost-4-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-beta-Cinnamoylandrost-4-en-3-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17-beta-Cinnamoylandrost-4-en-3-one?
The CAS number of 17-beta-Cinnamoylandrost-4-en-3-one is 103281-82-9.
What is the molecular formula of 17-beta-Cinnamoylandrost-4-en-3-one?
The molecular formula of 17-beta-Cinnamoylandrost-4-en-3-one is C28H34O2.
What is the molecular weight of 17-beta-Cinnamoylandrost-4-en-3-one?
The molecular weight of 17-beta-Cinnamoylandrost-4-en-3-one is 402.26 g/mol.
Where can I buy 17-beta-Cinnamoylandrost-4-en-3-one?
You can request a quote for 17-beta-Cinnamoylandrost-4-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-beta-Cinnamoylandrost-4-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 17-beta-Cinnamoylandrost-4-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.