N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid
TL;DR: N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid (CAS 148581-40-2) is a chemical compound with molecular formula C15H18N2O2 and molecular weight 258.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-2-methyl-1-oxoisoquinoline-4-carboxamide
Also Known As: mercaptoethylmethyldimethoxysilane, 1,2-Dihydro-2-methyl-N-(1-methylpropyl)-1-oxo-4-isoquinolinecarboxamide, N-butan-2-yl-2-methyl-1-oxoisoquinoline-4-carboxamide, 4-Isoquinolinecarboxamide, 1,2-dihydro-2-methyl-N-(1-methylpropyl)-1-oxo-, N-(sec-Butyl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
| Molecular Formula | C15H18N2O2 |
|---|---|
| Molecular Weight | 258.14 g/mol |
| LogP | 2.0668 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.13684 |
| Heavy Atoms | 19 |
| Complexity | 673.3902 |
Chemical Identifiers
| CAS Number | 148581-40-2 |
|---|---|
| SMILES | CCC(C)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C |
Product Overview
N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid (CAS 148581-40-2), with molecular formula C15H18N2O2 and molecular weight 258.14 g/mol. IUPAC: N-butan-2-yl-2-methyl-1-oxoisoquinoline-4-carboxamide.
Chemical Property Profile of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid
Property Insights of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid
The XLogP value of 2.0668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid. With a topological polar surface area (TPSA) of 51.1 Ų, N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid has 1 hydrogen bond donor(s) and 2 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-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid?
The CAS number of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid is 148581-40-2.
What is the molecular formula of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid?
The molecular formula of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid is C15H18N2O2.
What is the molecular weight of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid?
The molecular weight of N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid is 258.14 g/mol.
Where can I buy N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid?
You can request a quote for N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(Butan-2-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.