N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide
TL;DR: N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide (CAS 848732-72-9) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-oxo-1H-2-benzofuran-1-yl)-N-propan-2-ylacetamide
Also Known As: ChemDiv2_001528, 2-(3-oxo-1H-2-benzofuran-1-yl)-N-propan-2-ylacetamide, N-isopropyl-2-(3-oxo-1,3-dihydroisobenzofuran-1-yl)acetamide, 2-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-(propan-2-yl)acetamide, N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide
| Molecular Formula | C13H15NO3 |
|---|---|
| Molecular Weight | 233.11 g/mol |
| LogP | 1.8128 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.1052 |
| Heavy Atoms | 17 |
| Complexity | 453.73273 |
Chemical Identifiers
| CAS Number | 848732-72-9 |
|---|---|
| SMILES | CC(C)NC(=O)CC1C2=CC=CC=C2C(=O)O1 |
Product Overview
N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide (CAS 848732-72-9), with molecular formula C13H15NO3 and molecular weight 233.11 g/mol. IUPAC: 2-(3-oxo-1H-2-benzofuran-1-yl)-N-propan-2-ylacetamide.
Chemical Property Profile of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide
Property Insights of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide
The XLogP value of 1.8128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide. With a topological polar surface area (TPSA) of 55.4 Ų, N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide 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 N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide?
The CAS number of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide is 848732-72-9.
What is the molecular formula of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide?
The molecular formula of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide is C13H15NO3.
What is the molecular weight of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide?
The molecular weight of N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide is 233.11 g/mol.
Where can I buy N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide?
You can request a quote for N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-Isopropyl-2-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.