| Identification | Back Directory | [Name]
199657-47-1 | [CAS]
199657-47-1 | [Synonyms]
Givinostat Impurity 3
GivinostatImpurity3-d10
4-((((6-((diethylamino)methyl)naphthalen-2-yl)methoxy)carbonyl)amino)benzoic acid
Benzoic acid, 4-[[[[6-[(diethylamino)methyl]-2-naphthalenyl]methoxy]carbonyl]amino]- | [Molecular Formula]
C24H26N2O4 | [MOL File]
199657-47-1.mol | [Molecular Weight]
406.47 |
| Chemical Properties | Back Directory | [Boiling point ]
557.6±45.0 °C(Predicted) | [density ]
1.247±0.06 g/cm3(Predicted) | [pka]
4.31±0.10(Predicted) | [InChI]
InChI=1S/C24H26N2O4/c1-3-26(4-2)15-17-5-7-21-14-18(6-8-20(21)13-17)16-30-24(29)25-22-11-9-19(10-12-22)23(27)28/h5-14H,3-4,15-16H2,1-2H3,(H,25,29)(H,27,28) | [InChIKey]
NCHVNKHIEHGHEU-UHFFFAOYSA-N | [SMILES]
C(O)(=O)C1=CC=C(NC(OCC2=CC=C3C(=C2)C=CC(CN(CC)CC)=C3)=O)C=C1 |
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