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Home > Other Heterocycles > 785782-25-4
785782-25-4 | 8-benzyl-1,2,8-triazaspiro[4.5]decan-3-one
CAS No: 785782-25-4 Catalog No: AG00ISBI MDL No:MFCD08689731
Product Description
Catalog Number:
AG00ISBI
Chemical Name:
8-benzyl-1,2,8-triazaspiro[4.5]decan-3-one
CAS Number:
785782-25-4
Molecular Formula:
C14H19N3O
Molecular Weight:
245.3202
MDL Number:
MFCD08689731
IUPAC Name:
8-benzyl-1,2,8-triazaspiro[4.5]decan-3-one
InChI:
InChI=1S/C14H19N3O/c18-13-10-14(16-15-13)6-8-17(9-7-14)11-12-4-2-1-3-5-12/h1-5,16H,6-11H2,(H,15,18)
InChI Key:
GAWGGDNMPCOVJM-UHFFFAOYSA-N
SMILES:
O=C1NNC2(C1)CCN(CC2)Cc1ccccc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.153g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.326g/mol
Monoisotopic Mass:
245.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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