chempirical

N-[2-[(4-Hydroxyphenyl)amino]-3-pyridinyl]-4-methoxybenzenesulfonamide

C18H17N3O4SCAS 141430-65-1371.41 g/mol

Open in Covalent MOL file
OSOOHNNNHHO
EtherPhenolSecondary amineSulfonamide

Properties

Molecular formula
C18H17N3O4S
Molar mass
371.41 g/mol
Exact mass
371.0940 Da
logP
3.34Crippen estimate
Polar surface area
100.5 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
6

Identifiers

CAS number
141430-65-1
SMILES
COc1ccc(S(=O)(=O)Nc2cccnc2Nc2ccc(O)cc2)cc1
InChIKey
URCVCIZFVQDVPM-UHFFFAOYSA-N
InChI
InChI=1S/C18H17N3O4S/c1-25-15-8-10-16(11-9-15)26(23,24)21-17-3-2-12-19-18(17)20-13-4-6-14(22)7-5-13/h2-12,21-22H,1H3,(H,19,20)

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Names and synonyms

6 names
  • Benzenesulfonamide, N-[2-[(4-hydroxyphenyl)amino]-3-pyridinyl]-4-methoxy-
  • E 7010
  • E 7010 (Pharmaceutical)
  • N-[2-[(4-Hydroxyphenyl)amino]-3-pyridyl]-4-methoxybenzenesulfonamide
  • ABT 51
  • ABT 751

Work with N-[2-[(4-Hydroxyphenyl)amino]-3-pyridinyl]-4-methoxybenzenesulfonamide

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

N-(4-Hydroxyphenyl)benzenesulfonamide5471-90-942 % similar 4-Methoxybenzenesulfonic acid hydrazide1950-68-140 % similar 4-Methoxyphenol150-76-538 % similar N-(4-Methoxyphenyl)aniline1208-86-235 % similar Sulfadoxine2447-57-635 % similar 4-Methoxybenzenesulfonamide1129-26-634 % similar Sulfadiazine68-35-933 % similar Sulfamonomethoxine1220-83-333 % similar

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

Elsewhere

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