2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate
TL;DR: 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate (CAS 16119-56-5) is a chemical compound with molecular formula C25H29NO5 and molecular weight 423.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate
[2-oxo-2-(6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,11,14,17-tetraen-8-yl)ethyl] acetate
Also Known As: 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate, 21-Hydroxy-2'-methyl-16-beta-5'H-pregna-1,4,9(11)-trieno(17,16-d)oxazole-3,20-dione 21-acetate, 21-hydroxy-2'-methyl-16-beta-5'H-pregna-1,4,9(11)-trieno[17,16-d]oxazole-3,20-dione 21-acetate
| Molecular Formula | C25H29NO5 |
|---|---|
| Molecular Weight | 423.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.20456 |
| Heavy Atoms | 31 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 16119-56-5 |
|---|---|
| SMILES | CC1=NC2(C(O1)CC3C2(CC=C4C3CCC5=CC(=O)C=CC54C)C)C(=O)COC(=O)C |
| InChIKey | WMPWEDBGNZYKAO-UHFFFAOYSA-N |
Product Overview
2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate (CAS 16119-56-5), with molecular formula C25H29NO5 and molecular weight 423.20 g/mol. IUPAC: [2-oxo-2-(6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,11,14,17-tetraen-8-yl)ethyl] acetate.
Chemical Property Profile of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate
Property Insights of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate. Following Lipinski's Rule of Five, 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate has 0 hydrogen bond donor(s) and 6 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 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate?
The CAS number of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate is 16119-56-5.
What is the molecular formula of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate?
The molecular formula of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate is C25H29NO5.
What is the molecular weight of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate?
The molecular weight of 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate is 423.20 g/mol.
Where can I buy 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate?
You can request a quote for 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,4a,6,6a,9a,10,10a,10b,11,12-decahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.