123458-65-1
N-(4,6-DIMETHYL-2-PYRIMIDINYL)-4-METHYLBENZENESULFONAMIDE
NameN-(4,6-DIMETHYL-2-PYRIMIDINYL)-4-METHYLBENZENESULFONAMIDE
1Identification
【Name】
N-(4,6-DIMETHYL-2-PYRIMIDINYL)-4-METHYLBENZENESULFONAMIDE
【CAS】
【MDL】
MFCD00436892
【English Synonyms】
【Formula】
C13 H15 N3 O2 S
【MolWeight】
277.346
【Inchi】
InChI=1S/C13H15N3O2S/c1-9-4-6-12(7-5-9)19(17,18)16-13-14-10(2)8-11(3)15-13/h4-8H,1-3H3,(H,14,15,16)
【InChIKey】
InChIKey=PJKGKLPRSSNDFO-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)Nc2nc(cc(n2)C)C
【MOL File】
N-(4,6-DIMETHYL-2-PY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(4,6-DIMETHYL-2-PYRIMIDINYL)-4-METHYLBENZENESULFONAMIDE.cml