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Pagoclone

C23H22ClN3O2CAS 133737-32-3407.90 g/mol

Open in Covalent MOL file
OONClNN
AmideAryl halideKetoneLactam

Properties

Molecular formula
C23H22ClN3O2
Molar mass
407.90 g/mol
Exact mass
407.1401 Da
logP
5.38Crippen estimate
Polar surface area
63.2 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
133737-32-3
SMILES
CC(C)CCC(=O)CC1c2ccccc2C(=O)N1c1ccc2ccc(Cl)nc2n1
InChIKey
HIUPRQPBWVEQJJ-UHFFFAOYNA-N
InChI
InChI=1/C23H22ClN3O2/c1-14(2)7-10-16(28)13-19-17-5-3-4-6-18(17)23(29)27(19)21-12-9-15-8-11-20(24)25-22(15)26-21/h3-6,8-9,11-12,14,19H,7,10,13H2,1-2H3

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Names and synonyms

5 names
  • 1H-Isoindol-1-one, 2-(7-chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-(5-methyl-2-oxohexyl)-, (+)-
  • (+)-2-(7-Chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-(5-methyl-2-oxohexyl)-1H-isoindol-1-one
  • (+)-RP 59037
  • RP 62955
  • IP 456

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Similar compounds

2-(4-Oxocyclohexyl)-1H-isoindole-1,3(2H)-dione104618-32-832 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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