2-(3-nitro-1H-1,2,4-triazol-1-yl)-1-(10H-phenothiazin-10-yl)ethan-1-one
Chemical Structure Depiction of
2-(3-nitro-1H-1,2,4-triazol-1-yl)-1-(10H-phenothiazin-10-yl)ethan-1-one
2-(3-nitro-1H-1,2,4-triazol-1-yl)-1-(10H-phenothiazin-10-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8009-4708 |
| Compound Name: | 2-(3-nitro-1H-1,2,4-triazol-1-yl)-1-(10H-phenothiazin-10-yl)ethan-1-one |
| Molecular Weight: | 353.36 |
| Molecular Formula: | C16 H11 N5 O3 S |
| Smiles: | C(C(N1c2ccccc2Sc2ccccc12)=O)n1cnc(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4706 |
| logD: | 2.4706 |
| logSw: | -2.4739 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.01 |
| InChI Key: | IREHUNCBMLIGFO-UHFFFAOYSA-N |