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N-(2-{4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl}ethyl)naphthalene-2-carboxamide

N-(2-{4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl}ethyl)naphthalene-2-carboxamide

CAS: 1130067-34-3

Formula: C26H28N4O2

SMILES: O=C(NCCN1CCC2(CC1)N(CNC2=O)C1=CC=CC=C1)C1=CC2=CC=CC=C2C=C1

IUPAC: N-(2-{4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl}ethyl)naphthalene-2-carboxamide

InChI: InChI=1S/C26H28N4O2/c31-24(22-11-10-20-6-4-5-7-21(20)18-22)27-14-17-29-15-12-26(13-16-29)25(32)28-19-30(26)23-8-2-1-3-9-23/h1-11,18H,12-17,19H2,(H,27,31)(H,28,32)

Composition: C (72.87%), H (6.59%), N (13.07%), O (7.47%)

Molar Mass: 428.536

Atom Count: 60

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 428.221226158
Formal Charge 0
FSP3 0.31
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey FAIFAFUXFFWVNQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 126.14
Topological Polar Surface Area 64.68
Polarizability 49.27
Ring Count 5
Rotatable Bond Count 5

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