Nazartinib
N-[7-chloro-1-[(3R)-1-[(E)-4-(dimethylamino)but-2-enoyl]azepan-3-yl]benzimidazol-2-yl]-2-methylpyridine-4-carboxamide
Molecular Identity
Nazartinib
N-[7-chloro-1-[(3R)-1-[(E)-4-(dimethylamino)but-2-enoyl]azepan-3-yl]benzimidazol-2-yl]-2-methylpyridine-4-carboxamide
PubChem CID: 72703790
2D Structure
Properties
C26H31ClN6O2
Molecular Formula
495.00
Molecular Weight
g/mol
494.2197
Exact Mass
Da
3.2
XLogP
Drug-like (Lipinski: < 5)
83.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
764
Complexity
SMILES
Canonical SMILES
SMILES: CC1=NC=CC(=C1)C(=O)NC2=NC3=C(N2C4CCCCN(C4)C(=O)C=CCN(C)C)C(=CC=C3)ClIsomeric SMILES
SMILES: CC1=NC=CC(=C1)C(=O)NC2=NC3=C(N2[C@@H]4CCCCN(C4)C(=O)/C=C/CN(C)C)C(=CC=C3)ClSynonyms(20)
nazartinib1508250-71-2EGF816EGF-816NVP-EGF816-NXEGF 816KE7K32EME8(R,E)-N-(7-chloro-1-(1-(4-(dimethylamino)but-2-enoyl)azepan-3-yl)-1H-benzo[d]imidazol-2-yl)-2-methylisonicotinamideN-{7-chloro-1-[(3R)-1-[(2E)-4-(dimethylamino)but-2-enoyl]azepan-3-yl]-1H-1,3-benzodiazol-2-yl}-2-methylpyridine-4-carboxamidenazartinibum(R,E)-N-(7-chloro-1-(1-(4-(dimethylamino)but-2-enoyl)azepan-3-yl)-1H-benzo(d)imidazol-2-yl)-2-methylisonicotinamideN-(7-chloro-1-((3R)-1-((2E)-4-(dimethylamino)but-2-enoyl)azepan-3-yl)-1H-1,3-benzodiazol-2-yl)-2-methylpyridine-4-carboxamideRefChem:832112Nazartinib [USAN]Nazartinib(EGF816)
Data from PubChem (NCBI)
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