1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
Compound characteristics
Compound ID: | D344-9189 |
Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one |
Molecular Weight: | 382.4 |
Molecular Formula: | C18 H14 N4 O4 S |
Smiles: | C1CN(C(CSc2nnc(c3ccc(cc3)[N+]([O-])=O)o2)=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 3.1047 |
logD: | 3.1047 |
logSw: | -3.5312 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 78.869 |
InChI Key: | UWGCDAIHSFTZNQ-UHFFFAOYSA-N |