339107-90-3
2-METHYL-4-PHENYL-5-(PHENYLSULFONYL)PYRIMIDINE
Name2-METHYL-4-PHENYL-5-(PHENYLSULFONYL)PYRIMIDINE
1Identification
【Name】
2-METHYL-4-PHENYL-5-(PHENYLSULFONYL)PYRIMIDINE
【CAS】
【MDL】
MFCD00202573
【English Synonyms】
【Formula】
C17 H14 N2 O2 S
【MolWeight】
310.376
【Inchi】
InChI=1S/C17H14N2O2S/c1-13-18-12-16(17(19-13)14-8-4-2-5-9-14)22(20,21)15-10-6-3-7-11-15/h2-12H,1H3
【InChIKey】
InChIKey=MPDDDAPQTMRCCQ-UHFFFAOYSA-N
【SMILES】
Cc1ncc(c(n1)c2ccccc2)S(=O)(=O)c3ccccc3
【MOL File】
2-METHYL-4-PHENYL-5-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-4-PHENYL-5-(PHENYLSULFONYL)PYRIMIDINE.cml