N-phenyl-N'-(4-sulfanylidene-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-2-yl)thiourea
Chemical Structure Depiction of
N-phenyl-N'-(4-sulfanylidene-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-2-yl)thiourea
N-phenyl-N'-(4-sulfanylidene-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-2-yl)thiourea
Compound characteristics
| Compound ID: | 4934-0055 |
| Compound Name: | N-phenyl-N'-(4-sulfanylidene-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-2-yl)thiourea |
| Molecular Weight: | 369.49 |
| Molecular Formula: | C16 H11 N5 S3 |
| Smiles: | c1ccc(cc1)NC(NC1=NC(N2C(=N1)Sc1ccccc12)=S)=S |
| Stereo: | ACHIRAL |
| logP: | 3.1958 |
| logD: | 3.1955 |
| logSw: | -3.4537 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.413 |
| InChI Key: | PANQQPHFVSDEFO-UHFFFAOYSA-N |