chempirical

Fmoc-cha-oh

C24H27NO4CAS 135673-97-1393.48 g/mol

Open in Covalent MOL file
OOHNHOO
CarbamateCarboxylic acid

Properties

Molecular formula
C24H27NO4
Molar mass
393.48 g/mol
Exact mass
393.1940 Da
logP
4.95Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
135673-97-1
SMILES
C1CCC(CC1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChIKey
HIJAUEZBPWTKIV-QFIPXVFZSA-N
InChI
InChI=1S/C24H27NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,16,21-22H,1-3,8-9,14-15H2,(H,25,28)(H,26,27)/t22-/m0/s1

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Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2R)-2-(((9H-Fluoren-9-ylmethoxy)carbonyl)amino)-4-methylpentanoic acid114360-54-273 % similar Fmoc-lys-oh105047-45-872 % similar Fmoc-D-nle-oh112883-41-771 % similar Fmoc-D-ser-oh116861-26-870 % similar Fmoc-asp(ochex)-oh130304-80-270 % similar Fmoc-L-homophenylalanine132684-59-469 % similar Fmoc-L-glutamic acid121343-82-668 % similar Fmoc-L-aspartic acid119062-05-467 % similar

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

Same formula

(αR)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]cyclohexanepropanoic acid144701-25-7

Elsewhere

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