510762-45-5
2-IMINO-1-(2-METHOXYETHYL)-5-OXO-N-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
Name2-IMINO-1-(2-METHOXYETHYL)-5-OXO-N-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
1Identification
【Name】
2-IMINO-1-(2-METHOXYETHYL)-5-OXO-N-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD03510173
【English Synonyms】
【Formula】
C21 H20 N6 O3
【MolWeight】
404.428
【Inchi】
InChI=1S/C21H20N6O3/c1-30-10-9-27-18(22)15(20(28)24-13-14-5-4-7-23-12-14)11-16-19(27)25-17-6-2-3-8-26(17)21(16)29/h2-8,11-12,22H,9-10,13H2,1H3,(H,24,28)
【InChIKey】
InChIKey=MYNSGLRSVUMFSX-UHFFFAOYSA-N
【SMILES】
COCCn1c(=N)c(cc2c1nc3ccccn3c2=O)C(=O)NCc4cccnc4
【MOL File】
2-IMINO-1-(2-METHOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-IMINO-1-(2-METHOXYETHYL)-5-OXO-N-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE.cml