3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-
TL;DR: 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- (CAS 39191-73-6) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methylamino)-1,4-dihydroisoquinolin-3-one
Also Known As: 1,4-Dihydro-2-methylaminoisoquinolin-3(2H)-one, 3(2H)-ISOQUINOLINONE, 1,4-DIHYDRO-2-(METHYLAMINO)-, 2-(methylamino)-1,4-dihydroisoquinolin-3-one, 2-(Methylamino)-1,4-dihydro-3(2H)-isoquinolinone, 2-methylamino-1,4-dihydroisoquinolin-3-one
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 39191-73-6 |
|---|---|
| SMILES | CNN1CC2=CC=CC=C2CC1=O |
| InChIKey | LPMXHTSWSHVNSG-UHFFFAOYSA-N |
Product Overview
3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- (CAS 39191-73-6), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: 2-(methylamino)-1,4-dihydroisoquinolin-3-one.
Chemical Property Profile of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-
Property Insights of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-. With a topological polar surface area (TPSA) of 32.3 Ų, 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- 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 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-?
The CAS number of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- is 39191-73-6.
What is the molecular formula of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-?
The molecular formula of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- is C10H12N2O.
What is the molecular weight of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-?
The molecular weight of 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- is 176.09 g/mol.
Where can I buy 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-?
You can request a quote for 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Isoquinolinone, 1,4-dihydro-2-(methylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.