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1052587-88-8 | 5-methyl-5-(naphthalen-2-yl)-3-(2-oxo-2-(4-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)imidazolidine-2,4-dione
CAS No: 1052587-88-8 Catalog No: AG01DUY4 MDL No:MFCD08894242
Product Description
Catalog Number:
AG01DUY4
Chemical Name:
5-methyl-5-(naphthalen-2-yl)-3-(2-oxo-2-(4-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)imidazolidine-2,4-dione
CAS Number:
1052587-88-8
Molecular Formula:
C28H27N5O4
Molecular Weight:
497.5451
MDL Number:
MFCD08894242
IUPAC Name:
5-methyl-5-naphthalen-2-yl-3-[2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]imidazolidine-2,4-dione
InChI:
InChI=1S/C28H27N5O4/c1-28(20-11-10-18-6-2-3-7-19(18)16-20)25(35)32(27(37)30-28)17-24(34)31-14-12-21(13-15-31)33-23-9-5-4-8-22(23)29-26(33)36/h2-11,16,21H,12-15,17H2,1H3,(H,29,36)(H,30,37)
InChI Key:
JTNISJKQVMFTGB-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)n1c(=O)[nH]c2c1cccc2)CN1C(=O)NC(C1=O)(C)c1ccc2c(c1)cccc2
Properties
Complexity:
949
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
497.206g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
497.555g/mol
Monoisotopic Mass:
497.206g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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