Su-14813
5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
Molecular Identity
Su-14813
5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
PubChem CID: 10138259
2D Structure
Properties
C23H27FN4O4
Molecular Formula
442.50
Molecular Weight
g/mol
442.2016
Exact Mass
Da
0.9
XLogP
Drug-like (Lipinski: < 5)
107
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
6
H-Bond Acceptors
729
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(NC(=C1C(=O)NCC(CN2CCOCC2)O)C)C=C3C4=C(C=CC(=C4)F)NC3=OIsomeric SMILES
SMILES: CC1=C(NC(=C1C(=O)NC[C@@H](CN2CCOCC2)O)C)/C=C\3/C4=C(C=CC(=C4)F)NC3=OSynonyms(20)
452105-23-6SU-14813SU014813ZZ6VH5MZ171H-Pyrrole-3-carboxamide, 5-((5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl)-N-((2S)-2-hydroxy-3-(4-morpholinyl)propyl)-2,4-dimethyl-1H-Pyrrole-3-carboxamide, 5-((Z)-(5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl)-N-(2-hydroxy-3-(4-morpholinyl)propyl)-2,4-dimethyl-5-((Z)-(5-Fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl)-N-(2-hydroxy-3-morpholin-4-ylpropyl)-2,4-dimethyl-1H-pyrrole-3-carboxamideRefChem:1099116VEGFR2/PDGFR/c-Kit/Flt-3 Inhibitor SU0148135-(((3Z)-5-fluoro-2-oxo-2,3-dihydro-1H-indol-3-ylidene)methyl)-N-((2S)-2-hydroxy-3-(morpholin-4-yl)propyl)-2,4-dimethyl-3H-pyrrole-3-carboxamideSU14813 double bond ZSU14813SU 14813UNII-ZZ6VH5MZ17(S,Z)-5-((5-fluoro-2-oxoindolin-3-ylidene)methyl)-N-(2-hydroxy-3-morpholinopropyl)-2,4-dimethyl-1H-pyrrole-3-carboxamide
Data from PubChem (NCBI)
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