ethylallophanate
TL;DR: ethylallophanate (CAS 163061-08-3) is a chemical compound with molecular formula C19H30O and molecular weight 274.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: ethylallophanate, Androst-5-en-3-ol, NCIOpen2_004603, 2,3,4,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-10,13-DIMETHYL-1H-CYCLOPENTA[A]PHENANTHREN-3-OL, 406T307
| Molecular Formula | C19H30O |
|---|---|
| Molecular Weight | 274.23 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 274.22968 |
| Heavy Atoms | 20 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 163061-08-3 |
|---|---|
| SMILES | CC12CCCC1C3CC=C4CC(CCC4(C3CC2)C)O |
| InChIKey | LYFPAZBMEUSVNA-UHFFFAOYSA-N |
Product Overview
ethylallophanate (CAS 163061-08-3), with molecular formula C19H30O and molecular weight 274.23 g/mol. IUPAC: 10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of ethylallophanate
Property Insights of ethylallophanate
The XLogP value of 5.3 indicates that ethylallophanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, ethylallophanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethylallophanate has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethylallophanate?
The CAS number of ethylallophanate is 163061-08-3.
What is the molecular formula of ethylallophanate?
The molecular formula of ethylallophanate is C19H30O.
What is the molecular weight of ethylallophanate?
The molecular weight of ethylallophanate is 274.23 g/mol.
Where can I buy ethylallophanate?
You can request a quote for ethylallophanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethylallophanate?
Yes, KEHONG BIO provides custom synthesis services for ethylallophanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.