22407-74-5
1-[4-(6,7-DIMETHOXY-1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)BUTYL]-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
Name1-[4-(6,7-DIMETHOXY-1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)BUTYL]-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
1Identification
【Name】
1-[4-(6,7-DIMETHOXY-1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)BUTYL]-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
【CAS】
【MDL】
MFCD00867413
【English Synonyms】
【Formula】
C26 H36 N2 O4
【MolWeight】
440.58
【Inchi】
InChI=1S/C26H36N2O4/c1-29-23-13-17-9-11-27-21(19(17)15-25(23)31-3)7-5-6-8-22-20-16-26(32-4)24(30-2)14-18(20)10-12-28-22/h13-16,21-22,27-28H,5-12H2,1-4H3
【InChIKey】
InChIKey=CYVSPLIJDCJRGR-UHFFFAOYSA-N
【SMILES】
COc1cc2c(cc1OC)C(NCC2)CCCCC3c4cc(c(cc4CCN3)OC)OC
【MOL File】
1-[4-(6,7-DIMETHOXY-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[4-(6,7-DIMETHOXY-1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)BUTYL]-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE.cml