ChemDiv2_002202
TL;DR: ChemDiv2_002202 (CAS 296793-91-4) is a chemical compound with molecular formula C17H23NO4 and molecular weight 305.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-8,9-dimethoxy-1,10b-dimethyl-5,6-dihydro-[1,3]oxazolo[4,3-a]isoquinolin-3-one
Also Known As: ChemDiv2_002202, ZERO/001956, 1-Ethyl-1,5,6,10b-tetrahydro-8,9-dimethoxy-1,10b-dimethyl-3H-oxazolo[4,3-a]isoquinolin-3-one, 1-ethyl-8,9-dimethoxy-1,10b-dimethyl-1,5,6,10b-tetrahydro[1,3]oxazolo[4,3-a]isoquinolin-3-one, 1-ethyl-8,9-dimethoxy-1,10b-dimethyl-5,6-dihydro-[1,3]oxazolo[4,3-a]isoquinolin-3-one
| Molecular Formula | C17H23NO4 |
|---|---|
| Molecular Weight | 305.16 g/mol |
| LogP | 3.096 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.16272 |
| Heavy Atoms | 22 |
| Complexity | 629.3301 |
Chemical Identifiers
| CAS Number | 296793-91-4 |
|---|---|
| SMILES | CCC1(C2(C3=CC(=C(C=C3CCN2C(=O)O1)OC)OC)C)C |
Product Overview
ChemDiv2_002202 (CAS 296793-91-4), with molecular formula C17H23NO4 and molecular weight 305.16 g/mol. IUPAC: 1-ethyl-8,9-dimethoxy-1,10b-dimethyl-5,6-dihydro-[1,3]oxazolo[4,3-a]isoquinolin-3-one.
Chemical Property Profile of ChemDiv2_002202
Property Insights of ChemDiv2_002202
The XLogP value of 3.096 indicates that ChemDiv2_002202 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, ChemDiv2_002202 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_002202 has 0 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 ChemDiv2_002202?
The CAS number of ChemDiv2_002202 is 296793-91-4.
What is the molecular formula of ChemDiv2_002202?
The molecular formula of ChemDiv2_002202 is C17H23NO4.
What is the molecular weight of ChemDiv2_002202?
The molecular weight of ChemDiv2_002202 is 305.16 g/mol.
Where can I buy ChemDiv2_002202?
You can request a quote for ChemDiv2_002202 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_002202?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_002202 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.