519148-73-3
1H-INDOLE-1-CARBOXYLIC ACID, 5-[(4-METHYL-1-PIPERAZINYL)SULFONYL]-, 1,1-DIMETHYLETHYL ESTER
Name1H-INDOLE-1-CARBOXYLIC ACID, 5-[(4-METHYL-1-PIPERAZINYL)SULFONYL]-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
1H-INDOLE-1-CARBOXYLIC ACID, 5-[(4-METHYL-1-PIPERAZINYL)SULFONYL]-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD13183428
【English Synonyms】
【Formula】
C18 H25 N3 O4 S
【MolWeight】
379.478
【Inchi】
InChI=1S/C18H25N3O4S/c1-18(2,3)25-17(22)21-8-7-14-13-15(5-6-16(14)21)26(23,24)20-11-9-19(4)10-12-20/h5-8,13H,9-12H2,1-4H3
【InChIKey】
InChIKey=AZTUCDDBRHLQSD-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)n1ccc2c1ccc(c2)S(=O)(=O)N3CCN(CC3)C
【MOL File】
1H-INDOLE-1-CARBOXYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDOLE-1-CARBOXYLIC ACID, 5-[(4-METHYL-1-PIPERAZINYL)SULFONYL]-, 1,1-DIMETHYLETHYL ESTER.cml