2-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Chemical Structure Depiction of
2-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
2-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Compound characteristics
| Compound ID: | 5750-2657 |
| Compound Name: | 2-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C22 H19 N3 O S3 |
| Smiles: | C1CCc2c(C1)c1ccccc1n2C(CSC1=NN(C(=S)S1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6674 |
| logD: | 5.6672 |
| logSw: | -5.9981 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 28.9773 |
| InChI Key: | PXPCUWGCAGIOKR-UHFFFAOYSA-N |