![(17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile structure](/static/products/233/23330-13-4.png)
(17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile
TL;DR: (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile (CAS 23330-13-4) is a chemical compound with molecular formula C26H37NO2 and molecular weight 395.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ylidene]acetonitrile
Also Known As: (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile, (2Z)-2-[10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ylidene]acetonitrile
| Molecular Formula | C26H37NO2 |
|---|---|
| Molecular Weight | 395.28 g/mol |
| LogP | 6.31098 |
| Topological Polar Surface Area | 42.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 395.28244 |
| Heavy Atoms | 29 |
| Complexity | 742.2975 |
Chemical Identifiers
| CAS Number | 23330-13-4 |
|---|---|
| SMILES | CC1\2CCC3C(C1CC/C2=C/C#N)CC=C4C3(CCC(C4)OC5CCCCO5)C |
Product Overview
(17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile (CAS 23330-13-4), with molecular formula C26H37NO2 and molecular weight 395.28 g/mol. IUPAC: (2Z)-2-[10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ylidene]acetonitrile.
Chemical Property Profile of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile
Property Insights of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile
The XLogP value of 6.31098 indicates that (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.25 Ų, (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile?
The CAS number of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile is 23330-13-4.
What is the molecular formula of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile?
The molecular formula of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile is C26H37NO2.
What is the molecular weight of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile?
The molecular weight of (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile is 395.28 g/mol.
Where can I buy (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile?
You can request a quote for (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile?
Yes, KEHONG BIO provides custom synthesis services for (17Z)-3-[(Oxan-2-yl)oxy]pregna-5,17-diene-21-nitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.