2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide
TL;DR: 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide (CAS 26508-91-8) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-oxo-1,4-benzoxazin-4-yl)-N-propylacetamide
Also Known As: ChemDiv3_005888, IDI1_023798, 2-(3-oxo-1,4-benzoxazin-4-yl)-N-propylacetamide, 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide, 2-(3-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)-N-propylacetamide
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 0.9382 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 459.3045 |
Chemical Identifiers
| CAS Number | 26508-91-8 |
|---|---|
| SMILES | CCCNC(=O)CN1C(=O)COC2=CC=CC=C21 |
Product Overview
2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide (CAS 26508-91-8), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: 2-(3-oxo-1,4-benzoxazin-4-yl)-N-propylacetamide.
Chemical Property Profile of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide
Property Insights of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide
The XLogP value of 0.9382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide. With a topological polar surface area (TPSA) of 58.64 Ų, 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide has 1 hydrogen bond donor(s) and 3 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-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide?
The CAS number of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide is 26508-91-8.
What is the molecular formula of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide?
The molecular formula of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide is C13H16N2O3.
What is the molecular weight of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide?
The molecular weight of 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide is 248.12 g/mol.
Where can I buy 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide?
You can request a quote for 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-propylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.