1-(2-chloro-10H-phenothiazin-10-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(2-chloro-10H-phenothiazin-10-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
1-(2-chloro-10H-phenothiazin-10-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | Y020-0437 |
| Compound Name: | 1-(2-chloro-10H-phenothiazin-10-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 374.87 |
| Molecular Formula: | C16 H11 Cl N4 O S2 |
| Smiles: | C(C(N1c2ccccc2Sc2ccc(cc12)[Cl])=O)Sc1nnc[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.0477 |
| logD: | 2.6932 |
| logSw: | -3.5833 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.768 |
| InChI Key: | NXCVLSSRHZFJHI-UHFFFAOYSA-N |