596131-29-2
TERT-BUTYL 5-AMINO-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL(4-FLUOROPHENYL)CARBAMATE
NameTERT-BUTYL 5-AMINO-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL(4-FLUOROPHENYL)CARBAMATE
1Identification
【Name】
TERT-BUTYL 5-AMINO-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL(4-FLUOROPHENYL)CARBAMATE
【CAS】
【MDL】
MFCD22124981
【English Synonyms】
【Formula】
C19 H21 F N4 O2
【MolWeight】
356.399
【Inchi】
InChI=1S/C19H21FN4O2/c1-19(2,3)26-18(25)24(14-8-5-12(20)6-9-14)17-22-15-11-13(21)7-10-16(15)23(17)4/h5-11H,21H2,1-4H3
【InChIKey】
InChIKey=ZYNICEACVJPPLO-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N(c1ccc(cc1)F)c2nc3cc(ccc3n2C)N
【MOL File】
TERT-BUTYL 5-AMINO-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 5-AMINO-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL(4-FLUOROPHENYL)CARBAMATE.cml