chempirical

Carbidopa

C10H14N2O4CAS 28860-95-9226.23 g/mol

Open in Covalent MOL file
OHOHHNNH2OHO
Carboxylic acidPhenolPrimary amineSecondary amine

Properties

Molecular formula
C10H14N2O4
Molar mass
226.23 g/mol
Exact mass
226.0954 Da
Melting point
208 °C
logP
-0.05Crippen estimate
Polar surface area
115.8 Ų
H-bond donors / acceptors
5 / 5
Rotatable bonds
4
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
28860-95-9
SMILES
C[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O
InChIKey
TZFNLOMSOLWIDK-JTQLQIEISA-N
InChI
InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1

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

Names and synonyms

30 names · show all
  • Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (S)-
  • Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (αS)-
  • (αS)-α-Hydrazinyl-3,4-dihydroxy-α-methylbenzenepropanoic acid
  • L-α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid
  • MK 486
  • L-3-(3,4-Dihydroxyphenyl)-2-methyl-2-hydrazinopropionic acid
  • L-α-Methyl-α-hydrazino-β-(3,4-dihydroxyphenyl)propionic acid
  • L-α-Methyl-β-(3,4-dihydroxyphenyl)-α-hydrazinopropionic acid
  • L-α-Methyldopahydrazine
  • (-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinnamic acid monohydrate
  • L-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid
  • 1-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid
  • (-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinamic acid
  • α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid
  • α-Methyldopahydrazine
  • Hydrazino-α-methyldopa
  • L-α-Hydrazino-α-methyl-3,4-dihydroxyphenylpropionic acid
  • L-α-Methyl-α-hydrazino-3,4-dihydroxyphenylpropionic acid
  • N-Aminomethyldopa
  • L-α-Hydrazino-3,4-dihydroxy-α-methylbenzenepropanoic acid
  • Lodosyn
  • HMD
  • Lodosin
  • (S)-Carbidopa
  • L-Carbidopa
  • (2S)-2-(Aminoazaniumyl)-3-(3,4-dihydroxyphenyl)-2-methylpropanoate
  • (2S)-3-(3,4-Dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid
  • Cabidopa
  • Benzenepropanoic acid, α-hydrazinyl-3,4-dihydroxy-α-methyl-, (αS)-
  • Hydrocinnamic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, L-

Work with Carbidopa

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

Carbidopa monohydrate38821-49-793 % similar (±)-Methyldopa55-40-366 % similar (±)-Methyldopa555-29-366 % similar Methyldopa555-30-666 % similar (αS)-α-Hydrazinyl-3,4-dimethoxy-α-methylbenzenepropanoic acid28860-96-065 % similar (-)-3-(3,4-Dihydroxyphenyl)-2-methyl-L-alanine sesquihydrate41372-08-162 % similar N-(Aminocarbonyl)-3-methoxy-O,α-dimethyl-L-tyrosine28861-00-944 % similar α-Methyl-P-tyrosine658-48-043 % similar

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

Same formula

2-Propyl-1H-imidazole-4,5-dicarboxylic acid dimethyl ester124750-59-0 N,N-Dimethyl-p-phenylenediamine oxalate24631-29-6 3,4,5-Trimethoxybenzohydrazide3291-03-0 N1,N1-Dimethyl-1,4-benzenediamine ethanedioate (2:1)62778-12-5

Elsewhere

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