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1422134-12-0

1422134-12-0 | (5S,9S)-9-phenyl-2-thiophen-3-yl-2,7-diazaspiro[4.4]nonan-1-one

CAS No: 1422134-12-0 Catalog No: AG01DJCH MDL No:

Product Description

Catalog Number:
AG01DJCH
Chemical Name:
(5S,9S)-9-phenyl-2-thiophen-3-yl-2,7-diazaspiro[4.4]nonan-1-one
CAS Number:
1422134-12-0
Molecular Formula:
C17H18N2OS
Molecular Weight:
298.4026
IUPAC Name:
(5S,9S)-9-phenyl-2-thiophen-3-yl-2,7-diazaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C17H18N2OS/c20-16-17(7-8-19(16)14-6-9-21-11-14)12-18-10-15(17)13-4-2-1-3-5-13/h1-6,9,11,15,18H,7-8,10,12H2/t15-,17+/m0/s1
InChI Key:
VIQVIZPZLVVRSY-DOTOQJQBSA-N
SMILES:
O=C1N(CC[C@@]21CNC[C@H]2c1ccccc1)c1cscc1

Properties

Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
298.114g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
298.404g/mol
Monoisotopic Mass:
298.114g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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