510761-58-7
N-CYCLOHEXYL-2-IMINO-10-METHYL-5-OXO-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
NameN-CYCLOHEXYL-2-IMINO-10-METHYL-5-OXO-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
1Identification
【Name】
N-CYCLOHEXYL-2-IMINO-10-METHYL-5-OXO-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD03509742
【English Synonyms】
【Formula】
C25 H26 N6 O2
【MolWeight】
442.52
【Inchi】
InChI=1S/C25H26N6O2/c1-16-7-6-12-30-22(16)29-23-20(25(30)33)13-19(24(32)28-18-9-3-2-4-10-18)21(26)31(23)15-17-8-5-11-27-14-17/h5-8,11-14,18,26H,2-4,9-10,15H2,1H3,(H,28,32)
【InChIKey】
InChIKey=FZIDTGFRCBCPGX-UHFFFAOYSA-N
【SMILES】
Cc1cccn2c1nc3c(c2=O)cc(c(=N)n3Cc4cccnc4)C(=O)NC5CCCCC5
【MOL File】
N-CYCLOHEXYL-2-IMINO….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
N-CYCLOHEXYL-2-IMINO-10-METHYL-5-OXO-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE.cml