371244-11-0
2-(CHLOROMETHYL)-5-METHYL-3-O-TOLYLQUINAZOLIN-4(3H)-ONE
Name2-(CHLOROMETHYL)-5-METHYL-3-O-TOLYLQUINAZOLIN-4(3H)-ONE
1Identification
【Name】
2-(CHLOROMETHYL)-5-METHYL-3-O-TOLYLQUINAZOLIN-4(3H)-ONE
【CAS】
【MDL】
MFCD16876232
【English Synonyms】
【Formula】
C17 H15 Cl N2 O
【MolWeight】
298.772
【Inchi】
InChI=1S/C17H15ClN2O/c1-11-6-3-4-9-14(11)20-15(10-18)19-13-8-5-7-12(2)16(13)17(20)21/h3-9H,10H2,1-2H3
【InChIKey】
InChIKey=ZOTCSPSVHIKHBZ-UHFFFAOYSA-N
【SMILES】
Cc1ccccc1n2c(nc3cccc(c3c2=O)C)CCl
【MOL File】
2-(CHLOROMETHYL)-5-M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(CHLOROMETHYL)-5-METHYL-3-O-TOLYLQUINAZOLIN-4(3H)-ONE.cml