A2972/0125252
TL;DR: A2972/0125252 (CAS 474263-56-4) is a chemical compound with molecular formula C23H30O5 and molecular weight 386.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(4-tert-butylbenzoyl)-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
Also Known As: A2972/0125252, ethyl 6-(4-(tert-butyl)benzoyl)-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate, ethyl 6-(4-tert-butylbenzoyl)-6-ethyl-2,2-dimethyl-4-oxo-3-oxabicyclo[3.1.0]hexane-5-carboxylate, ETHYL 6-(4-TERT-BUTYLBENZOYL)-6-ETHYL-4,4-DIMETHYL-2-OXO-3-OXABICYCLO[3.1.0]HEXANE-1-CARBOXYLATE, ethyl 6-[(4-tert-butylphenyl)carbonyl]-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
| Molecular Formula | C23H30O5 |
|---|---|
| Molecular Weight | 386.21 g/mol |
| LogP | 4.0779 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.20932 |
| Heavy Atoms | 28 |
| Complexity | 829.5438 |
Chemical Identifiers
| CAS Number | 474263-56-4 |
|---|---|
| SMILES | CCC1(C2C1(C(=O)OC2(C)C)C(=O)OCC)C(=O)C3=CC=C(C=C3)C(C)(C)C |
Product Overview
A2972/0125252 (CAS 474263-56-4), with molecular formula C23H30O5 and molecular weight 386.21 g/mol. IUPAC: ethyl 6-(4-tert-butylbenzoyl)-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate.
Chemical Property Profile of A2972/0125252
Property Insights of A2972/0125252
The XLogP value of 4.0779 indicates that A2972/0125252 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for A2972/0125252. Following Lipinski's Rule of Five, A2972/0125252 has 0 hydrogen bond donor(s) and 5 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 A2972/0125252?
The CAS number of A2972/0125252 is 474263-56-4.
What is the molecular formula of A2972/0125252?
The molecular formula of A2972/0125252 is C23H30O5.
What is the molecular weight of A2972/0125252?
The molecular weight of A2972/0125252 is 386.21 g/mol.
Where can I buy A2972/0125252?
You can request a quote for A2972/0125252 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2972/0125252?
Yes, KEHONG BIO provides custom synthesis services for A2972/0125252 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.