Indolin-1-yl(5-methylisoxazol-3-yl)methanone
TL;DR: Indolin-1-yl(5-methylisoxazol-3-yl)methanone (CAS 830339-85-0) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroindol-1-yl-(5-methyl-1,2-oxazol-3-yl)methanone
Also Known As: Indolin-1-yl(5-methylisoxazol-3-yl)methanone, indolinyl 5-methylisoxazol-3-yl ketone, 1-[(5-methyl-3-isoxazolyl)carbonyl]indoline, 2,3-dihydroindol-1-yl-(5-methyl-1,2-oxazol-3-yl)methanone, (2,3-DIHYDRO-1H-INDOL-1-YL)(5-METHYL-3-ISOXAZOLYL)-METHANONE
| Molecular Formula | C13H12N2O2 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 2.18592 |
| Topological Polar Surface Area | 46.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.08987 |
| Heavy Atoms | 17 |
| Complexity | 574.30334 |
Chemical Identifiers
| CAS Number | 830339-85-0 |
|---|---|
| SMILES | CC1=CC(=NO1)C(=O)N2CCC3=CC=CC=C32 |
Product Overview
Indolin-1-yl(5-methylisoxazol-3-yl)methanone (CAS 830339-85-0), with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol. IUPAC: 2,3-dihydroindol-1-yl-(5-methyl-1,2-oxazol-3-yl)methanone.
Chemical Property Profile of Indolin-1-yl(5-methylisoxazol-3-yl)methanone
Property Insights of Indolin-1-yl(5-methylisoxazol-3-yl)methanone
The XLogP value of 2.18592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indolin-1-yl(5-methylisoxazol-3-yl)methanone. With a topological polar surface area (TPSA) of 46.34 Ų, Indolin-1-yl(5-methylisoxazol-3-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indolin-1-yl(5-methylisoxazol-3-yl)methanone has 0 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 Indolin-1-yl(5-methylisoxazol-3-yl)methanone?
The CAS number of Indolin-1-yl(5-methylisoxazol-3-yl)methanone is 830339-85-0.
What is the molecular formula of Indolin-1-yl(5-methylisoxazol-3-yl)methanone?
The molecular formula of Indolin-1-yl(5-methylisoxazol-3-yl)methanone is C13H12N2O2.
What is the molecular weight of Indolin-1-yl(5-methylisoxazol-3-yl)methanone?
The molecular weight of Indolin-1-yl(5-methylisoxazol-3-yl)methanone is 228.09 g/mol.
Where can I buy Indolin-1-yl(5-methylisoxazol-3-yl)methanone?
You can request a quote for Indolin-1-yl(5-methylisoxazol-3-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indolin-1-yl(5-methylisoxazol-3-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Indolin-1-yl(5-methylisoxazol-3-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.