1'-benzyl 1-tert-butyl 5-fluoro-2H-spiro[indole-3,4'-piperidine]-1,1'-dicarboxylate

1'-benzyl 1-tert-butyl 5-fluoro-2H-spiro[indole-3,4'-piperidine]-1,1'-dicarboxylate

CAS: 1201649-36-6

Formula: C25H29FN2O4

SMILES: CC(C)(C)OC(=O)N1CC2(CCN(CC2)C(=O)OCC2=CC=CC=C2)C2=C1C=CC(F)=C2

IUPAC: 1'-benzyl 1-tert-butyl 5-fluoro-1,2-dihydrospiro[indole-3,4'-piperidine]-1,1'-dicarboxylate

InChI: InChI=1S/C25H29FN2O4/c1-24(2,3)32-23(30)28-17-25(20-15-19(26)9-10-21(20)28)11-13-27(14-12-25)22(29)31-16-18-7-5-4-6-8-18/h4-10,15H,11-14,16-17H2,1-3H3

Composition: C (68.16%), H (6.64%), F (4.31%), N (6.36%), O (14.53%)

Molar Mass: 440.515

Atom Count: 61

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	440.211135585
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	YFQJCWCYBXZUEQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	118.89
Topological Polar Surface Area	59.08
Polarizability	45.87
Ring Count	4
Rotatable Bond Count	5

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