858645-53-1
1H-INDENE-1,3(2H)-DIONE, 2-[3-(2,5-DIMETHYLPHENYL)-3,4-DIHYDRO-8-METHOXY-4-OXO-2-QUINAZOLINYL]-
Name1H-INDENE-1,3(2H)-DIONE, 2-[3-(2,5-DIMETHYLPHENYL)-3,4-DIHYDRO-8-METHOXY-4-OXO-2-QUINAZOLINYL]-
1Identification
【Name】
1H-INDENE-1,3(2H)-DIONE, 2-[3-(2,5-DIMETHYLPHENYL)-3,4-DIHYDRO-8-METHOXY-4-OXO-2-QUINAZOLINYL]-
【CAS】
【MDL】
MFCD17018161
【English Synonyms】
【Formula】
C26 H20 N2 O4
【MolWeight】
424.454
【Inchi】
InChI=1S/C26H20N2O4/c1-14-11-12-15(2)19(13-14)28-25(21-23(29)16-7-4-5-8-17(16)24(21)30)27-22-18(26(28)31)9-6-10-20(22)32-3/h4-13,21H,1-3H3
【InChIKey】
InChIKey=RMIYHQYLBLUJDY-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)n2c(=O)c3cccc(c3nc2C4C(=O)c5ccccc5C4=O)OC)C
【MOL File】
1H-INDENE-1,3(2H)-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDENE-1,3(2H)-DIONE, 2-[3-(2,5-DIMETHYLPHENYL)-3,4-DIHYDRO-8-METHOXY-4-OXO-2-QUINAZOLINYL]-.cml