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101607-44-7 | 2,8-Diazaspiro[4.5]decane-1,3-dione, 2-(dimethylamino)-8-[4-(4-fluorophenyl)-4-oxobutyl]-
CAS No: 101607-44-7 Catalog No: AG0004YF MDL No:
Product Description
Catalog Number:
AG0004YF
Chemical Name:
2,8-Diazaspiro[4.5]decane-1,3-dione, 2-(dimethylamino)-8-[4-(4-fluorophenyl)-4-oxobutyl]-
CAS Number:
101607-44-7
Molecular Formula:
C20H26FN3O3
Molecular Weight:
375.4371
IUPAC Name:
2-(dimethylamino)-8-[4-(4-fluorophenyl)-4-oxobutyl]-2,8-diazaspiro[4.5]decane-1,3-dione
InChI:
InChI=1S/C20H26FN3O3/c1-22(2)24-18(26)14-20(19(24)27)9-12-23(13-10-20)11-3-4-17(25)15-5-7-16(21)8-6-15/h5-8H,3-4,9-14H2,1-2H3
InChI Key:
ILVXNXRHHAUIEM-UHFFFAOYSA-N
SMILES:
CN(N1C(=O)CC2(C1=O)CCN(CC2)CCCC(=O)c1ccc(cc1)F)C
NSC Number:
665793
Properties
Complexity:
579
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.196g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.444g/mol
Monoisotopic Mass:
375.196g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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