Fmoc-D-4-carbamoylphe

C25H22N2O5CAS 1217610-39-3430.46 g/mol

Open in Covalent MOL file
OONHOH2NOHO
AmideCarbamateCarboxylic 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 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
7
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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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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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-phe-oh286460-71-778 % similar Fmoc-D-phenylalanine86123-10-678 % similar Fmoc-bpa-oh117666-96-378 % similar Fmoc-4-amino-L-phenylalanine95753-56-378 % similar Fmoc-D-tyr-oh112883-29-177 % similar (2S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid92954-90-077 % similar Fmoc-L-4,4'-biphenylalanine199110-64-076 % similar Fmoc-D-4-chlorophe142994-19-275 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Dbco-C6-nhs ester1384870-47-6 5-Carboxytetramethylrhodamine91809-66-4 6-Carboxytetramethylrhodamine91809-67-5

Elsewhere

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