RefChem:297143
TL;DR: RefChem:297143 (CAS 91119-96-9) is a chemical compound with molecular formula C18H24N2O5 and molecular weight 348.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate
Also Known As: 4H-1,4-Benzoxazine-4-acetic acid, 6-acetyl-2,3-dihydro-3-oxo-, 2-(diethylamino)ethyl ester, 6-Acetyl-4-(N,N-diethylaminoethylcarboxymethyl)-2H-1,4-benzoxazin-3(4H)-one, 6-Acetyl-2,3-dihydro-3-oxo-4H-1,4-benzoxazine-4-acetic acid 2-(diethylamino)ethyl ester, 2-diethylaminoethyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate, 2-(diethylamino)ethyl (6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetate
| Molecular Formula | C18H24N2O5 |
|---|---|
| Molecular Weight | 348.17 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.16852 |
| Heavy Atoms | 25 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 91119-96-9 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)C |
| InChIKey | MXDDMLBNZIATSF-UHFFFAOYSA-N |
Product Overview
RefChem:297143 (CAS 91119-96-9), with molecular formula C18H24N2O5 and molecular weight 348.17 g/mol. IUPAC: 2-(diethylamino)ethyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate.
Chemical Property Profile of RefChem:297143
Property Insights of RefChem:297143
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:297143. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:297143. Following Lipinski's Rule of Five, RefChem:297143 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 RefChem:297143?
The CAS number of RefChem:297143 is 91119-96-9.
What is the molecular formula of RefChem:297143?
The molecular formula of RefChem:297143 is C18H24N2O5.
What is the molecular weight of RefChem:297143?
The molecular weight of RefChem:297143 is 348.17 g/mol.
Where can I buy RefChem:297143?
You can request a quote for RefChem:297143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:297143?
Yes, KEHONG BIO provides custom synthesis services for RefChem:297143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.