Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride
TL;DR: Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride (CAS 64097-17-2) is a chemical compound with molecular formula C15H15ClN2O and molecular weight 274.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-aminophenyl)-2,4-dihydro-1H-isoquinolin-2-ium-3-one chloride
Also Known As: 1-(4'-Aminophenyl)-3-oxotetrahydroisoquinoline hydrochloride, 1-(p-Aminophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one hydrochloride, ISOQUINOLIN-3-ONE, 1,2,3,4-TETRAHYDRO-1-(p-AMINOPHENYL)-, HYDROCHLORIDE, 1-(4-aminophenyl)-2,4-dihydro-1H-isoquinolin-2-ium-3-one chloride, 3(2H)-Isoquinolinone, 1,4-dihydro-1-(p-aminophenyl), monohydrochloride
| Molecular Formula | C15H15ClN2O |
|---|---|
| Molecular Weight | 274.09 g/mol |
| LogP | -1.99 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.08728 |
| Heavy Atoms | 19 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 64097-17-2 |
|---|---|
| SMILES | C1C2=CC=CC=C2C([NH2+]C1=O)C3=CC=C(C=C3)N.[Cl-] |
| InChIKey | LLTIMRCNHPKMDU-UHFFFAOYSA-N |
Product Overview
Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride (CAS 64097-17-2), with molecular formula C15H15ClN2O and molecular weight 274.09 g/mol. IUPAC: 1-(4-aminophenyl)-2,4-dihydro-1H-isoquinolin-2-ium-3-one chloride.
Chemical Property Profile of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride
Property Insights of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride
The XLogP value of -1.99 indicates that Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.7 Ų, Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride has 2 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 Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride?
The CAS number of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride is 64097-17-2.
What is the molecular formula of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride?
The molecular formula of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride is C15H15ClN2O.
What is the molecular weight of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride?
The molecular weight of Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride is 274.09 g/mol.
Where can I buy Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride?
You can request a quote for Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolin-3-one, 1,2,3,4-tetrahydro-1-(p-aminophenyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.