11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione
TL;DR: 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione (CAS 72968-80-0) is a chemical compound with molecular formula C21H30O4 and molecular weight 346.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11R,13S,14S,15S,17S)-17-acetyl-11,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 11a,15a-Dihydroxyprogesterone, 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione, J2.460.105F, 11, A,15
| Molecular Formula | C21H30O4 |
|---|---|
| Molecular Weight | 346.21 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.21442 |
| Heavy Atoms | 25 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 72968-80-0 |
|---|---|
| SMILES | CC(=O)[C@H]1C[C@@H]([C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O |
| InChIKey | BXGCPPYCSCLHER-LBZTYHDASA-N |
Product Overview
11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione (CAS 72968-80-0), with molecular formula C21H30O4 and molecular weight 346.21 g/mol. IUPAC: (8S,9S,10R,11R,13S,14S,15S,17S)-17-acetyl-11,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione
Property Insights of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione has 2 hydrogen bond donor(s) and 4 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 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione?
The CAS number of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione is 72968-80-0.
What is the molecular formula of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione?
The molecular formula of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione is C21H30O4.
What is the molecular weight of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione?
The molecular weight of 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione is 346.21 g/mol.
Where can I buy 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione?
You can request a quote for 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 11alpha,15alpha-Dihydroxypregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.