7-fluoro-3-{1-[(phenylsulfanyl)acetyl]piperidin-4-yl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
7-fluoro-3-{1-[(phenylsulfanyl)acetyl]piperidin-4-yl}-1,2,3-benzotriazin-4(3H)-one
7-fluoro-3-{1-[(phenylsulfanyl)acetyl]piperidin-4-yl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | M277-1424 |
| Compound Name: | 7-fluoro-3-{1-[(phenylsulfanyl)acetyl]piperidin-4-yl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C20 H19 F N4 O2 S |
| Smiles: | C1CN(CCC1N1C(c2ccc(cc2N=N1)F)=O)C(CSc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7976 |
| logD: | 3.7976 |
| logSw: | -4.0355 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.275 |
| InChI Key: | LTXUKMMUVBYOET-UHFFFAOYSA-N |