3-hydroxy-2,2-dimethyl-N-(2-{12-oxo-8,14-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,8,10,13(17),14-octaen-10-yl}ethyl)propanamide
AlkaPlorer ID: AK046702
Synonym: None
IUPAC Name: 3-hydroxy-2,2-dimethyl-N-[2-(12-oxo-8,14-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,10,13,15-octaen-10-yl)ethyl]propanamide
Structure
SMILES: CC(C)(CO)C(=O)NCCC1=CC(=O)C2=NC=CC3=C4C=CC=CC4=NC1=C23
InChI: InChI=1S/C22H21N3O3/c1-22(2,12-26)21(28)24-9-7-13-11-17(27)20-18-15(8-10-23-20)14-5-3-4-6-16(14)25-19(13)18/h3-6,8,10-11,26H,7,9,12H2,1-2H3,(H,24,28)
InChIKey: NWYDXNNQPKYQDB-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 375.4280000000001
TPSA？: 92.18
MolLogP？: 2.887500000000001
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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