N-Benzyloxycarbonyl-D-arginine

C₁₄H₂₀N₄O₄CAS 6382-93-0308.34 g/mol

Open in Covalent MOL file

Carboxylic acid Guanidine

Properties

Molecular formula: C₁₄H₂₀N₄O₄
Molar mass: 308.34 g/mol
Exact mass: 308.1485 Da
Melting point: 175 °C
logP: 0.83Crippen estimate
Polar surface area: 141.0 Å²
H-bond donors / acceptors: 5 / 4
Rotatable bonds: 8
Stereocentres: Rin SMILES atom order

Hazards

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

Identifiers

CAS number

6382-93-0

SMILES

N=C(N)NCCC[C@@H](N=C(O)OCc1ccccc1)C(=O)O

InChIKey

SJSSFUMSAFMFNM-LLVKDONJSA-N

InChI

InChI=1S/C14H20N4O4/c15-13(16)17-8-4-7-11(12(19)20)18-14(21)22-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H,18,21)(H,19,20)(H4,15,16,17)/t11-/m1/s1

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

Names and synonyms

4 names

D-Arginine, N2-[(phenylmethoxy)carbonyl]-
Arginine, N2-carboxy-, N2-benzyl ester, D-
N2-[(Phenylmethoxy)carbonyl]-D-arginine
(2R)-5-(Diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoic acid

Work with N-Benzyloxycarbonyl-D-arginine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Benzyloxycarbonyl-L-arginine1234-35-1Enantiomer L-Arginine, N2-[(phenylmethoxy)carbonyl]-, hydrochloride (1:1)56672-63-0Salt, enantiomer

Similar compounds

Benzoyl-L-arginine154-92-771 % similar N5-[Imino(nitroamino)methyl]-N2-[(phenylmethoxy)carbonyl]-L-ornithine2304-98-568 % similar N-α-Benzyloxycarbonyl-L-lysine2212-75-166 % similar N2-[(Phenylmethoxy)carbonyl]-L-glutamine2650-64-863 % similar N2,N6-Bis[(phenylmethoxy)carbonyl]-L-lysine405-39-063 % similar N-(Benzyloxycarbonyl)-L-glutamic acid1155-62-063 % similar N2-(tert-Butoxycarbonyl)-L-arginine13726-76-661 % similar N-((Phenylmethoxy)carbonyl)norvaline21691-43-061 % similar

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

Same formula

1,1-Dimethylethyl 4-(6-nitro-3-pyridinyl)-1-piperazinecarboxylate571189-16-7

Elsewhere

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