nedisertib
(S)-[2-chloro-4-fluoro-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl]-(6-methoxypyridazin-3-yl)methanol
Molecular Identity
nedisertib
(S)-[2-chloro-4-fluoro-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl]-(6-methoxypyridazin-3-yl)methanol
PubChem CID: 86292849
2D Structure
Properties
C24H21ClFN5O3
Molecular Formula
481.90
Molecular Weight
g/mol
481.1317
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
93.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
662
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
nedisertibpeposertib1637542-33-6M3814MSC2490484AM-3814MSC-2490484AGN429E725A(S)-[2-chloro-4-fluoro-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl]-(6-methoxypyridazin-3-yl)methanolMSC 2490484A3-Pyridazinemethanol, alpha-(2-chloro-4-fluoro-5-(7-(4-morpholinyl)-4-quinazolinyl)phenyl)-6-methoxy-, (alphaS)-peposertibum(S)-(2-chloro-4-fluoro-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl)-(6-methoxypyridazin-3-yl)methanolRefChem:171540M 3814
Data from PubChem (NCBI)
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