N,N,1-trimethyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-1'-sulfonamide

• ChemBase ID: 458271
• Molecular Formular: C15H21N3O3S
• Molecular Mass: 323.41054
• Monoisotopic Mass: 323.13036255
• SMILES: S(=O)(=O)(N1CCC2(C(=O)N(c3c2cccc3)C)CC1)N(C)C
• Canonical SMILES: O=C1N(C)c2c(C31CCN(CC3)S(=O)(=O)N(C)C)cccc2
• InChI: InChI=1S/C15H21N3O3S/c1-16(2)22(20,21)18-10-8-15(9-11-18)12-6-4-5-7-13(12)17(3)14(15)19/h4-7H,8-11H2,1-3H3
• InChIKey: OFYQIPKOADIFGO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N,1-trimethyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-1'-sulfonamide
• IUPAC Traditional name: N,N,1-trimethyl-2-oxospiro[indole-3,4'-piperidine]-1'-sulfonamide
• Synonyms: N,N,1-trimethyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-piperidine]-1'-sulfonamide

CALCULATED PROPERTIES

JChem

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -0.008549931
• LogD (pH = 7.4): -0.0085486015
• Log P: -0.008548585
• Molar Refractivity: 84.7415 cm^3
• Polarizability: 33.500824 Å^3
• Polar Surface Area: 60.93 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 3
• H Donor: 0
• Log P: 0.31
• LOG S: -3.13
• Polar Surface Area: 60.93 Å^2
• Rotatable Bonds: 0