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Home > Other Heterocycles > 1422139-77-2
1422139-77-2 | 2-(2-methylpropyl)spiro[1,5-dihydro-2-benzazepine-4,4'-piperidine]-3-one
CAS No: 1422139-77-2 Catalog No: AG01DIYA MDL No:
Product Description
Catalog Number:
AG01DIYA
Chemical Name:
2-(2-methylpropyl)spiro[1,5-dihydro-2-benzazepine-4,4'-piperidine]-3-one
CAS Number:
1422139-77-2
Molecular Formula:
C18H26N2O
Molecular Weight:
286.4118
IUPAC Name:
2-(2-methylpropyl)spiro[1,5-dihydro-2-benzazepine-4,4'-piperidine]-3-one
InChI:
InChI=1S/C18H26N2O/c1-14(2)12-20-13-16-6-4-3-5-15(16)11-18(17(20)21)7-9-19-10-8-18/h3-6,14,19H,7-13H2,1-2H3
InChI Key:
MLIGPFAWVSMROG-UHFFFAOYSA-N
SMILES:
CC(CN1Cc2ccccc2CC2(C1=O)CCNCC2)C
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.205g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.419g/mol
Monoisotopic Mass:
286.205g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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