Fmoc-D-4-carbamoylphe

C₂₅H₂₂N₂O₅CAS 1217610-39-3430.46 g/mol

Open in Covalent MOL file

Amide Carbamate Carboxylic acid

Properties

Molecular formula: C₂₅H₂₂N₂O₅
Molar mass: 430.46 g/mol
Exact mass: 430.1529 Da
logP: 3.32Crippen estimate
Polar surface area: 118.7 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 7
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

1217610-39-3

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)C(=O)N)C(=O)O

InChIKey

MUNGLNMRFZUOTD-JOCHJYFZSA-N

InChI

InChI=1S/C25H22N2O5/c26-23(28)16-11-9-15(10-12-16)13-22(24(29)30)27-25(31)32-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H2,26,28)(H,27,31)(H,29,30)/t22-/m1/s1

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Type any one amount. The others follow from the molar mass.

Work with Fmoc-D-4-carbamoylphe

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

Fmoc-bpa-oh117666-96-378 % similar Fmoc-D-tyr-oh112883-29-177 % similar Fmoc-tyr-tyr-oh1269665-49-771 % similar Fmoc-2-nal-oh112883-43-970 % similar (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(tert-butoxy)phenyl)propanoic acid118488-18-968 % similar Fmoc-D-asn-OH108321-39-767 % similar Fmoc-D-ser-oh116861-26-865 % similar Fmoc-L-homophenylalanine132684-59-464 % similar

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

Same formula

Dbco-C6-nhs ester1384870-47-6 6-Carboxytetramethylrhodamine91809-67-5

Elsewhere

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