Sid 769070
TL;DR: Sid 769070 (CAS 66680-04-4) is a chemical compound with molecular formula C21H28O2 and molecular weight 312.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,5aS,9aS,9bS)-3-ethynyl-3-hydroxy-3a-methyl-7-methylidenespiro[2,4,5,5a,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalene-6,2'-cyclopentane]-1'-one
Also Known As: Sid 769070, KST-1A7341, (3as,5as,9as,9bs)-3-ethynyl-3-hydroxy-3a-methyl-7-methylidenedodecahydro-2'h-spiro[cyclopenta[a]naphthalene-6,1'-cyclopentan]-2'-one, (3aS,5aS,9aS,9bS)-3-ethynyl-3-hydroxy-3a-methyl-7-methylidenespiro[2,4,5,5a,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalene-6,2'-cyclopentane]-1'-one, 3,19-Cyclo-3,4-secopregn-4-en-20-yn-1-one, 17-hydroxy-, (17alpha)-
| Molecular Formula | C21H28O2 |
|---|---|
| Molecular Weight | 312.21 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.20892 |
| Heavy Atoms | 23 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 66680-04-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)O)CCC(=C)C34CCCC4=O |
| InChIKey | NBAYWSQXNIPUON-BFEZYJIYSA-N |
Product Overview
Sid 769070 (CAS 66680-04-4), with molecular formula C21H28O2 and molecular weight 312.21 g/mol. IUPAC: (3aS,5aS,9aS,9bS)-3-ethynyl-3-hydroxy-3a-methyl-7-methylidenespiro[2,4,5,5a,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalene-6,2'-cyclopentane]-1'-one.
Chemical Property Profile of Sid 769070
Property Insights of Sid 769070
The XLogP value of 3.1 indicates that Sid 769070 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Sid 769070 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sid 769070 has 1 hydrogen bond donor(s) and 2 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 Sid 769070?
The CAS number of Sid 769070 is 66680-04-4.
What is the molecular formula of Sid 769070?
The molecular formula of Sid 769070 is C21H28O2.
What is the molecular weight of Sid 769070?
The molecular weight of Sid 769070 is 312.21 g/mol.
Where can I buy Sid 769070?
You can request a quote for Sid 769070 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sid 769070?
Yes, KEHONG BIO provides custom synthesis services for Sid 769070 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.