N-[[5-[(2S)-5-oxo-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]methyl]pyrimidine-5-carboxamide
AlkaPlorer ID: AK567410
Synonym: None
IUPAC Name: N-[[5-[(2S)-5-oxo-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]methyl]pyrimidine-5-carboxamide
Structure
SMILES: O=C(NCC1=NOC([C@@H]2CCC(=O)N2CC2=CC=NC=C2)=N1)C1=CN=CN=C1
InChI: InChI=1S/C18H17N7O3/c26-16-2-1-14(25(16)10-12-3-5-19-6-4-12)18-23-15(24-28-18)9-22-17(27)13-7-20-11-21-8-13/h3-8,11,14H,1-2,9-10H2,(H,22,27)/t14-/m0/s1
InChIKey: XDNSZEVSNNALJC-AWEZNQCLSA-N
Reference
5,10-<i>seco</i>-<i>neo</i>-Clerodanes and <i>neo</i>-Clerodanes from <i>Salvia microphylla</i>
PubChem CID: 145872633
Source
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Properties Information
Molecule Weight: 379.38
TPSA？: 127.0
MolLogP？: 1.0482999999999998
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 4
Activities Information
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