784140-65-4
1-(2',3'-DIMETHYL[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXAMIDE
Name1-(2',3'-DIMETHYL[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXAMIDE
1Identification
【Name】
1-(2',3'-DIMETHYL[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXAMIDE
【CAS】
【MDL】
MFCD13195198
【English Synonyms】
【Formula】
C19 H19 N3 O
【MolWeight】
305.379
【Inchi】
InChI=1S/C19H19N3O/c1-12-6-4-9-17(14(12)3)15-7-5-8-16(11-15)22-13(2)10-18(21-22)19(20)23/h4-11H,1-3H3,(H2,20,23)
【InChIKey】
InChIKey=GKKPNBSXJYVRRK-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1C)c2cccc(c2)n3c(cc(n3)C(=O)N)C
【MOL File】
1-(2',3'-DIMETHYL[1,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2',3'-DIMETHYL[1,1'-BIPHENYL]-3-YL)-5-METHYL-1H-PYRAZOLE-3-CARBOXAMIDE.cml