N-(3-nitrophenyl)-N-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]benzenesulfonamide
AlkaPlorer ID: AK345269
Synonym: None
IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(3-nitrophenyl)benzenesulfonamide
Structure
SMILES: O=C(CN(C1=CC([N+](=O)[O-])=CC=C1)S(=O)(=O)C1=CC=CC=C1)N1CCC2=CC=CC=C2C1
InChI: InChI=1S/C23H21N3O5S/c27-23(24-14-13-18-7-4-5-8-19(18)16-24)17-25(20-9-6-10-21(15-20)26(28)29)32(30,31)22-11-2-1-3-12-22/h1-12,15H,13-14,16-17H2
InChIKey: BNDFIKUKAJYWHV-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 451.5040000000002
TPSA？: 100.83
MolLogP？: 3.3750000000000018
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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