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1422062-44-9

1422062-44-9 | (5S,9S)-9-phenyl-2-(pyridin-3-ylmethyl)-2,7-diazaspiro[4.4]nonan-1-one

CAS No: 1422062-44-9 Catalog No: AG01DJKZ MDL No:

Product Description

Catalog Number:
AG01DJKZ
Chemical Name:
(5S,9S)-9-phenyl-2-(pyridin-3-ylmethyl)-2,7-diazaspiro[4.4]nonan-1-one
CAS Number:
1422062-44-9
Molecular Formula:
C19H21N3O
Molecular Weight:
307.3895
IUPAC Name:
(5S,9S)-9-phenyl-2-(pyridin-3-ylmethyl)-2,7-diazaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C19H21N3O/c23-18-19(8-10-22(18)13-15-5-4-9-20-11-15)14-21-12-17(19)16-6-2-1-3-7-16/h1-7,9,11,17,21H,8,10,12-14H2/t17-,19+/m0/s1
InChI Key:
VWXMVCFFAFFUBD-PKOBYXMFSA-N
SMILES:
O=C1N(CC[C@@]21CNC[C@H]2c1ccccc1)Cc1cccnc1

Properties

Complexity:
434  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
307.168g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.397g/mol
Monoisotopic Mass:
307.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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