N-Benzyloxycarbonyl-L-leucine dicyclohexylamine salt

C26H42N2O4CAS 53363-87-4446.63 g/mol

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NHNHOOOOH
Carboxylic acidSecondary amine

Properties

Molecular formula
C26H42N2O4
Molar mass
446.63 g/mol
Exact mass
446.3145 Da
logP
5.86Crippen estimate
Polar surface area
91.2 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
8
Stereocentres
Sin 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
53363-87-4
SMILES
C1CCC(NC2CCCCC2)CC1.CC(C)C[C@H](N=C(O)OCc1ccccc1)C(=O)O
InChIKey
FOULZFSGIVQTHX-YDALLXLXSA-N
InChI
InChI=1S/C14H19NO4.C12H23N/c1-10(2)8-12(13(16)17)15-14(18)19-9-11-6-4-3-5-7-11;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h3-7,10,12H,8-9H2,1-2H3,(H,15,18)(H,16,17);11-13H,1-10H2/t12-;/m0./s1

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Names and synonyms

4 names
  • L-Leucine, N-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)
  • L-Leucine, N-carboxy-, N-benzyl ester, dicyclohexylamine salt
  • N-Benzyloxycarbonylleucine dicyclohexylammonium salt
  • NSC 352097

Work with N-Benzyloxycarbonyl-L-leucine dicyclohexylamine salt

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-leucine2018-66-8Free acid N-Carbobenzoxy-dl-leucine3588-60-1Free acid, stereo not defined N-Cbz-D-leucine28862-79-5Free acid, enantiomer Dicyclohexylamine101-83-7Free base Z-D-Leu-OH.DCHA7662-58-0Enantiomer Dicyclohexylammonium nitrite3129-91-7Salt L-Lysine, N6-[(1,1-dimethylethoxy)carbonyl]-N2-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)2212-76-2Salt Nα-tert-Butoxycarbonyl-Nε-benzyloxycarbonyl-L-lysine compound with dicyclohexylamine (1:1)16948-04-2Salt N-Carbobenzoxy-L-aspartic acid β-tert-butyl ester dicyclohexylamine salt (1:1)23632-70-4Salt Boc-His(Boc)-OH dicyclohexylamine (1:1)31687-58-8Salt N-Benzyloxycarbonyl-L-isoleucine dicyclohexylamine salt26699-00-3Salt D-Lysine, N2-[(1,1-dimethylethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)76477-42-4Salt

Similar compounds

N-((Phenylmethoxy)carbonyl)norvaline21691-43-063 % similar (S)-2-(((Benzyloxy)carbonyl)amino)pentanoic acid21691-44-163 % similar N-α-Benzyloxycarbonyl-L-lysine2212-75-163 % similar N2,N6-Bis[(phenylmethoxy)carbonyl]-L-lysine405-39-063 % similar (2S)-2-(((Phenylmethoxy)carbonyl)amino)butanoic acid42918-86-562 % similar Benzyloxycarbonyl-L-phenylalanine1161-13-362 % similar N-(Benzyloxycarbonyl)-D-phenylalanine2448-45-562 % similar N-(Benzyloxycarbonyl)-dl-phenylalanine3588-57-662 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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