556821-36-4
3-(4-CHLOROPHENYL)-2-((1-NAPHTHYLMETHYL)THIO)-4(3H)-QUINAZOLINONE
Name3-(4-CHLOROPHENYL)-2-((1-NAPHTHYLMETHYL)THIO)-4(3H)-QUINAZOLINONE
1Identification
【Name】
3-(4-CHLOROPHENYL)-2-((1-NAPHTHYLMETHYL)THIO)-4(3H)-QUINAZOLINONE
【CAS】
【MDL】
MFCD03223457
【English Synonyms】
【Formula】
C25 H17 Cl N2 O S
【MolWeight】
428.941
【Inchi】
InChI=1S/C25H17ClN2OS/c26-19-12-14-20(15-13-19)28-24(29)22-10-3-4-11-23(22)27-25(28)30-16-18-8-5-7-17-6-1-2-9-21(17)18/h1-15H,16H2
【InChIKey】
InChIKey=FHKWDYPDRXTRQT-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)cccc2CSc3nc4ccccc4c(=O)n3c5ccc(cc5)Cl
【MOL File】
3-(4-CHLOROPHENYL)-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(4-CHLOROPHENYL)-2-((1-NAPHTHYLMETHYL)THIO)-4(3H)-QUINAZOLINONE.cml