NCIOpen2_007892
TL;DR: NCIOpen2_007892 (CAS 55230-47-2) is a chemical compound with molecular formula C19H26O4 and molecular weight 318.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-10a,12a-dimethyl-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromene-2,8-dione
Also Known As: NCIOpen2_007892, 7.alpha.-Hydroxytestololactone, 7-.alpha.-hydroxytestololactone, Testololactone, 7.alpha.-hydroxy-, D-Homo-17a-oxaandrost-4-ene-3,1-b]pyran
| Molecular Formula | C19H26O4 |
|---|---|
| Molecular Weight | 318.18 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 318.1831 |
| Heavy Atoms | 23 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 55230-47-2 |
|---|---|
| SMILES | CC12CCC(=O)C=C1CC(C3C2CCC4(C3CCC(=O)O4)C)O |
| InChIKey | FOXXEHXXDDNIKJ-UHFFFAOYSA-N |
Product Overview
NCIOpen2_007892 (CAS 55230-47-2), with molecular formula C19H26O4 and molecular weight 318.18 g/mol. IUPAC: 5-hydroxy-10a,12a-dimethyl-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromene-2,8-dione.
Chemical Property Profile of NCIOpen2_007892
Property Insights of NCIOpen2_007892
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCIOpen2_007892. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for NCIOpen2_007892. Following Lipinski's Rule of Five, NCIOpen2_007892 has 1 hydrogen bond donor(s) and 4 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 NCIOpen2_007892?
The CAS number of NCIOpen2_007892 is 55230-47-2.
What is the molecular formula of NCIOpen2_007892?
The molecular formula of NCIOpen2_007892 is C19H26O4.
What is the molecular weight of NCIOpen2_007892?
The molecular weight of NCIOpen2_007892 is 318.18 g/mol.
Where can I buy NCIOpen2_007892?
You can request a quote for NCIOpen2_007892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_007892?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_007892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.