N-[3-(cyclohexylsulfanyl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[3-(cyclohexylsulfanyl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
Compound ID: | C791-0141 |
Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
Molecular Weight: | 426.6 |
Molecular Formula: | C23 H26 N2 O2 S2 |
Smiles: | C1CCC(CC1)SCCCNC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0831 |
logD: | 5.0822 |
logSw: | -5.0891 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.623 |
InChI Key: | CTIYDNAMSQPFDA-UHFFFAOYSA-N |