510761-84-9
2-IMINO-1-[3-(4-MORPHOLINYL)PROPYL]-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
Name2-IMINO-1-[3-(4-MORPHOLINYL)PROPYL]-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
1Identification
【Name】
2-IMINO-1-[3-(4-MORPHOLINYL)PROPYL]-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD03509861
【English Synonyms】
【Formula】
C27 H30 N6 O3
【MolWeight】
486.573
【Inchi】
InChI=1S/C27H30N6O3/c28-24-21(26(34)29-11-10-20-7-2-1-3-8-20)19-22-25(30-23-9-4-5-13-32(23)27(22)35)33(24)14-6-12-31-15-17-36-18-16-31/h1-5,7-9,13,19,28H,6,10-12,14-18H2,(H,29,34)
【InChIKey】
InChIKey=MYQMLIGHBQDVAW-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)CCNC(=O)c2cc3c(nc4ccccn4c3=O)n(c2=N)CCCN5CCOCC5
【MOL File】
2-IMINO-1-[3-(4-MORP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-IMINO-1-[3-(4-MORPHOLINYL)PROPYL]-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE.cml