Nicandrenone
TL;DR: Nicandrenone (CAS 40071-64-5) is a chemical compound with molecular formula C28H34O6 and molecular weight 466.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-16-[1-(2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl)ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one
Also Known As: Nicandrenone, 2,3-anhydro-4,6,7-trideoxy-6-(1b-hydroxy-5a-methyl-5-oxo-1a,1b,2,5,5a,5b,6,7,11b,11c-decahydrochryseno[5,6-b]oxiren-9-yl)-2,3-dimethylheptopyranose, 5-hydroxy-16-[1-(2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl)ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one, D(17a)-Homo-18-norergosta-2,13,15,17-tetraen-1-one, 6,7:22,26:24,25-triepoxy-5,26-dihydroxy-, (5alpha,6alpha,7alpha,22R,24S,25S,26R)-
| Molecular Formula | C28H34O6 |
|---|---|
| Molecular Weight | 466.24 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 466.23553 |
| Heavy Atoms | 34 |
| Complexity | 949.0 |
Chemical Identifiers
| CAS Number | 40071-64-5 |
|---|---|
| SMILES | CC(C1CC2(C(O2)(C(O1)O)C)C)C3=CC4=C(C=C3)C5C(CC4)C6(C(=O)C=CCC6(C7C5O7)O)C |
| InChIKey | PWHVEHULNLETOV-UHFFFAOYSA-N |
Product Overview
Nicandrenone (CAS 40071-64-5), with molecular formula C28H34O6 and molecular weight 466.24 g/mol. IUPAC: 5-hydroxy-16-[1-(2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl)ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one.
Chemical Property Profile of Nicandrenone
Property Insights of Nicandrenone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicandrenone. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Nicandrenone. Following Lipinski's Rule of Five, Nicandrenone has 2 hydrogen bond donor(s) and 6 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 Nicandrenone?
The CAS number of Nicandrenone is 40071-64-5.
What is the molecular formula of Nicandrenone?
The molecular formula of Nicandrenone is C28H34O6.
What is the molecular weight of Nicandrenone?
The molecular weight of Nicandrenone is 466.24 g/mol.
Where can I buy Nicandrenone?
You can request a quote for Nicandrenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicandrenone?
Yes, KEHONG BIO provides custom synthesis services for Nicandrenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.