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Home > Quinoline > 304659-09-4
304659-09-4 | 2(1H)-Isoquinolinecarboxamide, 3,4-dihydro-N-(4-methylphenyl)-
CAS No: 304659-09-4 Catalog No: AG00307E MDL No:
Product Description
Catalog Number:
AG00307E
Chemical Name:
2(1H)-Isoquinolinecarboxamide, 3,4-dihydro-N-(4-methylphenyl)-
CAS Number:
304659-09-4
Molecular Formula:
C17H18N2O
Molecular Weight:
266.3376
IUPAC Name:
N-(4-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
InChI:
InChI=1S/C17H18N2O/c1-13-6-8-16(9-7-13)18-17(20)19-11-10-14-4-2-3-5-15(14)12-19/h2-9H,10-12H2,1H3,(H,18,20)
InChI Key:
NNKREQOEPILALQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NC(=O)N1CCc2c(C1)cccc2
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.344g/mol
Monoisotopic Mass:
266.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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