SU4984

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.

Phenylpiperazines

Organic compounds

Organoheterocyclic compounds

Diazinanes

Piperazines

Calculated Property

kind Value Source
logP 2.29 ALOGPS
logS -3.5 ALOGPS
Water Solubility 1.05e-01 g/l ALOGPS
logP 2.33 ChemAxon
IUPAC Name 4-(4-{[(3R)-2-oxo-2,3-dihydro-1H-indol-3-yl]methyl}phenyl)piperazine-1-carbaldehyde ChemAxon
Traditional IUPAC Name 4-(4-{[(3R)-2-oxo-1,3-dihydroindol-3-yl]methyl}phenyl)piperazine-1-carbaldehyde ChemAxon
Molecular Weight 335.3996 ChemAxon
Monoisotopic Weight 335.163376931 ChemAxon
SMILES [H][C@]1(CC2=CC=C(C=C2)N2CCN(CC2)C=O)C(=O)NC2=C1C=CC=C2 ChemAxon
Molecular Formula C20H21N3O2 ChemAxon
InChI InChI=1S/C20H21N3O2/c24-14-22-9-11-23(12-10-22)16-7-5-15(6-8-16)13-18-17-3-1-2-4-19(17)21-20(18)25/h1-8,14,18H,9-13H2,(H,21,25)/t18-/m1/s1 ChemAxon
InChIKey InChIKey=AZGZGRJOCKSSHA-GOSISDBHSA-N ChemAxon
Polar Surface Area (PSA) 52.65 ChemAxon
Refractivity 99.11 ChemAxon
Polarizability 37.1 ChemAxon
Rotatable Bond Count 3 ChemAxon
H Bond Acceptor Count 3 ChemAxon
H Bond Donor Count 1 ChemAxon
pKa (strongest acidic) 13.3 ChemAxon
pKa (strongest basic) 3.33 ChemAxon
Physiological Charge 0 ChemAxon
Number of Rings 4 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 1 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • Fibroblast growth factor receptor 2 : in Human
  • Fibroblast growth factor receptor 1 : in Human