83722-15-0
4(3H)-QUINAZOLINONE, 2-(4-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMIN O)-2-HYDROXYPROPOXY)PHENYL)-6-METHOXY-3-METHYL-, DIHYDROCHLORIDE
Name4(3H)-QUINAZOLINONE, 2-(4-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMIN O)-2-HYDROXYPROPOXY)PHENYL)-6-METHOXY-3-METHYL-, DIHYDROCHLORIDE
FormulaC30 H35 N3 O6 . 2 Cl H
1Identification
【Name】
4(3H)-QUINAZOLINONE, 2-(4-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMIN O)-2-HYDROXYPROPOXY)PHENYL)-6-METHOXY-3-METHYL-, DIHYDROCHLORIDE
【CAS】
【MDL】
MFCD01766158
【English Synonyms】
【Formula】
C30 H35 N3 O6 . 2 Cl H
【MolWeight】
606.543
【Inchi】
InChI=1S/C30H35N3O6.2ClH/c1-32(15-14-20-6-13-27(37-4)28(16-20)38-5)18-22(34)19-39-23-9-7-21(8-10-23)29-31-26-12-11-24(36-3)17-25(26)30(35)33(29)2;;/h6-13,16-17,22,34H,14-15,18-19H2,1-5H3;2*1H
【InChIKey】
InChIKey=VBUXKMVYLBCERW-UHFFFAOYSA-N
【SMILES】
Cn1c(=O)c2cc(ccc2nc1c3ccc(cc3)OCC(CN(C)CCc4ccc(c(c4)OC)OC)O)OC.Cl.Cl
【MOL File】
4(3H)-QUINAZOLINONE,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4(3H)-QUINAZOLINONE, 2-(4-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMIN O)-2-HYDROXYPROPOXY)PHENYL)-6-METHOXY-3-METHYL-, DIHYDROCHLORIDE.cml