(2S)-5-(tert-butoxy)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl](methyl)amino}-5-oxopentanoic acid

(2S)-5-(tert-butoxy)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl](methyl)amino}-5-oxopentanoic acid

CAS: 200616-40-6

Formula: C25H29NO6

SMILES: CN([C@@H](CCC(=O)OC(C)(C)C)C(O)=O)C(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2

IUPAC: (2S)-5-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(methyl)amino)-5-oxopentanoic acid

InChI: InChI=1S/C25H29NO6/c1-25(2,3)32-22(27)14-13-21(23(28)29)26(4)24(30)31-15-20-18-11-7-5-9-16(18)17-10-6-8-12-19(17)20/h5-12,20-21H,13-15H2,1-4H3,(H,28,29)/t21-/m0/s1

Composition: C (68.32%), H (6.65%), N (3.19%), O (21.84%)

Molar Mass: 439.508

Atom Count: 61

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	439.199487658
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	FVUASVBQADLDRO-NRFANRHFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	118.84
Topological Polar Surface Area	93.14
Polarizability	47.65
Ring Count	3
Rotatable Bond Count	10

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