(8S)-9-[(2,4-difluorophenyl)carbonyl]-2-(morpholin-4-yl)-8-(trifluoromethyl)-6,7,8,9-tetra-hydro-4 H-pyrimido[1,2-a]pyrimidin-4-one

HCID 49854504
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Basic information

Standard SMILES
O=C(c1ccc(F)cc1F)N1c2nc(N3CCOCC3)cc(=O)n2CC[C@H]1C(F)(F)F
InChIKey
PXPFKPUGXQTRBP-AWEZNQCLSA-N
Molecular formula
C19H17F5N4O3
Average molar mass
444.4 g/mol

Names & identifiers

Preferred name
(8S)-9-[(2,4-difluorophenyl)carbonyl]-2-(morpholin-4-yl)-8-(trifluoromethyl)-6,7,8,9-tetra-hydro-4 H-pyrimido[1,2-a]pyrimidin-4-one
IUPAC
(8S)-9-(2,4-difluorobenzoyl)-2-morpholin-4-yl-8-(trifluoromethyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one

Names & synonyms

(8S)-9-[(2,4-difluorophenyl)carbonyl]-2-(morpholin-4-yl)-8-(trifluoromethyl)-6,7,8,9-tetra-hydro-4 H-pyrimido[1,2-a]pyrimidin-4-oneSCHEMBL932050(8S)-9-[(2,4-difluorophenyl)carbonyl]-2-(morpholin-4-yl)-8-(trifluoromethyl)-6,7,8,9-tetra-hydro-4H-pyrimido[1,2-a]pyrimidin-4-one

Database identifiers

PubChem CID
49854504

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
65.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
2
Heavy atoms
31

Related reactions

1 records
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Compound notes

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