EINECS 246-470-2
TL;DR: EINECS 246-470-2 (CAS 24808-87-5) is a chemical compound with molecular formula C25H30O8 and molecular weight 458.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethoxy]-4-oxobutanoic acid
Also Known As: 4-[(17-hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoic acid, 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione 21-(hydrogen succinate), 4-[2-(17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethoxy]-4-oxobutanoic acid, B2699-133037, 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione21-(hydrogensuccinate)
| Molecular Formula | C25H30O8 |
|---|---|
| Molecular Weight | 458.19 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 458.19406 |
| Heavy Atoms | 33 |
| Complexity | 992.0 |
Chemical Identifiers
| CAS Number | 24808-87-5 |
|---|---|
| SMILES | CC12CC(=O)C3C(C1CCC2(C(=O)COC(=O)CCC(=O)O)O)CCC4=CC(=O)C=CC34C |
| InChIKey | IMWBZDUOZWSUQI-UHFFFAOYSA-N |
Product Overview
EINECS 246-470-2 (CAS 24808-87-5), with molecular formula C25H30O8 and molecular weight 458.19 g/mol. IUPAC: 4-[2-(17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethoxy]-4-oxobutanoic acid.
Chemical Property Profile of EINECS 246-470-2
Property Insights of EINECS 246-470-2
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 246-470-2. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 246-470-2. Following Lipinski's Rule of Five, EINECS 246-470-2 has 2 hydrogen bond donor(s) and 8 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 EINECS 246-470-2?
The CAS number of EINECS 246-470-2 is 24808-87-5.
What is the molecular formula of EINECS 246-470-2?
The molecular formula of EINECS 246-470-2 is C25H30O8.
What is the molecular weight of EINECS 246-470-2?
The molecular weight of EINECS 246-470-2 is 458.19 g/mol.
Where can I buy EINECS 246-470-2?
You can request a quote for EINECS 246-470-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 246-470-2?
Yes, KEHONG BIO provides custom synthesis services for EINECS 246-470-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.