chempirical

Fenoldopam

C16H16ClNO3CAS 67227-56-9305.76 g/mol

Open in Covalent MOL file
OHNHOHHOCl
Aryl halidePhenolSecondary amine

Properties

Molecular formula
C16H16ClNO3
Molar mass
305.76 g/mol
Exact mass
305.0819 Da
logP
2.73Crippen estimate
Polar surface area
72.7 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
1

Identifiers

CAS number
67227-56-9
SMILES
Oc1ccc(C2CNCCc3c2cc(O)c(O)c3Cl)cc1
InChIKey
TVURRHSHRRELCG-UHFFFAOYSA-N
InChI
InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2

Weigh it out

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

Names and synonyms

5 names
  • 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)-
  • 6-Chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)-1H-3-benzazepine-7,8-diol
  • SKF 82526
  • (±)-SKF 82526
  • (±)-Fenoldopam

Work with Fenoldopam

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

Fenoldopam mesylate67227-57-081 % similar Higenamine5843-65-233 % similar Chlorohydroquinone615-67-832 % similar (±)-Demethylcoclaurine hydrochloride11041-94-431 % similar

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

Same formula

Ethyl 7-chloro-1-cyclopropyl-1,4-dihydro-8-methyl-4-oxo-3-quinolinecarboxylate103877-51-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook