510761-57-6
2-IMINO-10-METHYL-5-OXO-N-(1-PHENYLETHYL)-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
Name2-IMINO-10-METHYL-5-OXO-N-(1-PHENYLETHYL)-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
1Identification
【Name】
2-IMINO-10-METHYL-5-OXO-N-(1-PHENYLETHYL)-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD03509738
【English Synonyms】
【Formula】
C27 H24 N6 O2
【MolWeight】
464.527
【Inchi】
InChI=1S/C27H24N6O2/c1-17-8-7-13-32-24(17)31-25-22(27(32)35)14-21(23(28)33(25)16-19-9-6-12-29-15-19)26(34)30-18(2)20-10-4-3-5-11-20/h3-15,18,28H,16H2,1-2H3,(H,30,34)
【InChIKey】
InChIKey=UUSMEHDVSFFTBU-UHFFFAOYSA-N
【SMILES】
Cc1cccn2c1nc3c(c2=O)cc(c(=N)n3Cc4cccnc4)C(=O)NC(C)c5ccccc5
【MOL File】
2-IMINO-10-METHYL-5-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-IMINO-10-METHYL-5-OXO-N-(1-PHENYLETHYL)-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE.cml