17-Cmnt
TL;DR: 17-Cmnt (CAS 78-18-2) is a chemical compound with molecular formula C20H27NO2 and molecular weight 313.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8R,9S,10R,13S,14S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]acetonitrile
Also Known As: 17-Cmnt, KST-1A8213, 17alpha-Cyanomethyl-19-nortestosterone, (17-hydroxy-3-oxoestr-4-en-17-yl)acetonitrile, 17-Hydroxy-3-oxo-19-norpregn-4-ene-21-nitrile
| Molecular Formula | C20H27NO2 |
|---|---|
| Molecular Weight | 313.20 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.2042 |
| Heavy Atoms | 23 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 78-18-2 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(CC#N)O)CCC4=CC(=O)CC[C@H]34 |
| InChIKey | MGEXGMZKAAFZNS-CEXWFGIZSA-N |
Product Overview
17-Cmnt (CAS 78-18-2), with molecular formula C20H27NO2 and molecular weight 313.20 g/mol. IUPAC: 2-[(8R,9S,10R,13S,14S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]acetonitrile.
Chemical Property Profile of 17-Cmnt
Property Insights of 17-Cmnt
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17-Cmnt. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 17-Cmnt. Following Lipinski's Rule of Five, 17-Cmnt has 1 hydrogen bond donor(s) and 3 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 17-Cmnt?
The CAS number of 17-Cmnt is 78-18-2.
What is the molecular formula of 17-Cmnt?
The molecular formula of 17-Cmnt is C20H27NO2.
What is the molecular weight of 17-Cmnt?
The molecular weight of 17-Cmnt is 313.20 g/mol.
Where can I buy 17-Cmnt?
You can request a quote for 17-Cmnt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-Cmnt?
Yes, KEHONG BIO provides custom synthesis services for 17-Cmnt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.