137382-10-6
2-METHYL-4-(5-THIAZOLYL)-1(2H)-PHTHALAZINONE
Name2-METHYL-4-(5-THIAZOLYL)-1(2H)-PHTHALAZINONE
1Identification
【Name】
2-METHYL-4-(5-THIAZOLYL)-1(2H)-PHTHALAZINONE
【CAS】
【MDL】
MFCD00924522
【English Synonyms】
【Formula】
C12 H9 N3 O S
【MolWeight】
243.289
【Inchi】
InChI=1S/C12H9N3OS/c1-15-12(16)9-5-3-2-4-8(9)11(14-15)10-6-13-7-17-10/h2-7H,1H3
【InChIKey】
InChIKey=KYHISOZRMVLEAX-UHFFFAOYSA-N
【SMILES】
Cn1c(=O)c2ccccc2c(n1)c3cncs3
【MOL File】
2-METHYL-4-(5-THIAZO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-4-(5-THIAZOLYL)-1(2H)-PHTHALAZINONE.cml