161696-76-0
2-METHYL-4-(1-PIPERAZINYL)-10H-THIENOL[2,3-B][1,5]BENZODIAZEPINE
Name2-METHYL-4-(1-PIPERAZINYL)-10H-THIENOL[2,3-B][1,5]BENZODIAZEPINE
1Identification
【Name】
2-METHYL-4-(1-PIPERAZINYL)-10H-THIENOL[2,3-B][1,5]BENZODIAZEPINE
【CAS】
【MDL】
MFCD09840321
【English Synonyms】
【Formula】
C16 H18 N4 S
【MolWeight】
298.412
【Inchi】
InChI=1S/C16H18N4S/c1-11-10-12-15(20-8-6-17-7-9-20)18-13-4-2-3-5-14(13)19-16(12)21-11/h2-5,10,17,19H,6-9H2,1H3
【InChIKey】
InChIKey=FHPIXVHJEIZKJW-UHFFFAOYSA-N
【SMILES】
Cc1cc2c(s1)Nc3ccccc3N=C2N4CCNCC4
【MOL File】
2-METHYL-4-(1-PIPERA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-4-(1-PIPERAZINYL)-10H-THIENOL[2,3-B][1,5]BENZODIAZEPINE.cml