O-(1,1-Dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-methyl-L-serine

C₂₃H₂₇NO₅CAS 914399-98-7397.47 g/mol

Open in Covalent MOL file

Carboxylic acid Ether

Properties

Molecular formula: C₂₃H₂₇NO₅
Molar mass: 397.47 g/mol
Exact mass: 397.1889 Da
logP: 4.39Crippen estimate
Polar surface area: 88.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 6
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

914399-98-7

SMILES

CC(C)(C)OC[C@](C)(N=C(O)OCC1c2ccccc2-c2ccccc21)C(=O)O

InChIKey

WRDFKKLMQLSBQN-QHCPKHFHSA-N

InChI

InChI=1S/C23H27NO5/c1-22(2,3)29-14-23(4,20(25)26)24-21(27)28-13-19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19/h5-12,19H,13-14H2,1-4H3,(H,24,27)(H,25,26)/t23-/m0/s1

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Names and synonyms

1 names

L-Serine, O-(1,1-dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-methyl-

Work with O-(1,1-Dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-methyl-L-serine

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

N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-methyl-L-leucine312624-65-074 % similar 2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]-2-methylpropionic acid94744-50-069 % similar 1-[(Fmoc)amino]cyclohexanecarboxylic acid162648-54-661 % similar N-(9-Fluorenylmethoxycarbonyl)-O-tert-butylserine71989-33-860 % similar 1-(9H-Fluoren-9-ylmethyl) 4-[[(1,1-dimethylethoxy)carbonyl]amino]-1,4-piperidinedicarboxylate368866-07-355 % similar N-[(1,1-Dimethylethoxy)carbonyl]-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-D-alanine131570-56-452 % similar Fmoc-L-asp(otbu)-oh71989-14-552 % similar Fmoc-L-tyr(tbu)-oh71989-38-352 % similar

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

Same formula

Nalpha-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-threonine tert-Butyl Ester120791-76-6 Fmoc-O-tert-butyl-D-threonine138797-71-4 Fmoc-L-statine158257-40-0 Fmoc-D-allo-thr(tbu)-oh170643-02-4 (3R)-4-(1,1-Dimethylethoxy)-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]butanoic acid203854-51-7 N-(9-Fluorenylmethoxycarbonyl)-O-tert-butylthreonine71989-35-0

Elsewhere

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