3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one
TL;DR: 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one (CAS 18630-98-3) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-morpholin-4-yl-2H-isoquinolin-1-one
Also Known As: 3-(morpholin-4-yl)-1,2-dihydroisoquinolin-1-one, 3-morpholinoisocarbostyril, 3-morpholin-4-yl-2H-isoquinolin-1-one, CC-PMLSC-PW-wdpNB4017, 3-morpholin-4-ylisoquinolin-1(2H)-one
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 1.3647 |
| Topological Polar Surface Area | 45.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 585.2343 |
Chemical Identifiers
| CAS Number | 18630-98-3 |
|---|---|
| SMILES | C1COCCN1C2=CC3=CC=CC=C3C(=O)N2 |
Product Overview
3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one (CAS 18630-98-3), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 3-morpholin-4-yl-2H-isoquinolin-1-one.
Chemical Property Profile of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one
Property Insights of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one
The XLogP value of 1.3647 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one. With a topological polar surface area (TPSA) of 45.33 Ų, 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one 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 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one?
The CAS number of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one is 18630-98-3.
What is the molecular formula of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one?
The molecular formula of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one is C13H14N2O2.
What is the molecular weight of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one?
The molecular weight of 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one is 230.11 g/mol.
Where can I buy 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one?
You can request a quote for 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(Morpholin-4-yl)-1,2-dihydroisoquinolin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.