chempirical

Amfonelic acid

C18H16N2O3CAS 15180-02-6308.34 g/mol

Open in Covalent MOL file
NOOHON
Carboxylic acid

Properties

Molecular formula
C18H16N2O3
Molar mass
308.34 g/mol
Exact mass
308.1161 Da
logP
2.71Crippen estimate
Polar surface area
72.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
15180-02-6
SMILES
CCn1cc(C(=O)O)c(=O)c2ccc(Cc3ccccc3)nc21
InChIKey
WHHHJDGNBVQNAU-UHFFFAOYSA-N
InChI
InChI=1S/C18H16N2O3/c1-2-20-11-15(18(22)23)16(21)14-9-8-13(19-17(14)20)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,22,23)

Weigh it out

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

Names and synonyms

7 names
  • 1,8-Naphthyridine-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-7-(phenylmethyl)-
  • 1,8-Naphthyridine-3-carboxylic acid, 7-benzyl-1-ethyl-1,4-dihydro-4-oxo-
  • 1-Ethyl-1,4-dihydro-4-oxo-7-(phenylmethyl)-1,8-naphthyridine-3-carboxylic acid
  • 7-Benzyl-1-ethyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • NCA
  • Win 25978
  • NSC 100638

Work with Amfonelic acid

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

Nalidixic acid389-08-266 % similar Pipemidic acid51940-44-452 % similar Enoxacin74011-58-849 % similar Nalidixic acid sodium salt3374-05-847 % similar Enoxacin sesquihydrate84294-96-246 % similar Oxolinic acid14698-29-446 % similar 7-Chloro-1-ethyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid68077-26-944 % similar 1-(Phenylmethyl)-1H-indole-3-carboxylic acid27018-76-442 % similar

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

Elsewhere

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