4,6-dimethyl-3-[5-(1,1,2,2-tetrafluoroethyl)-2,3-dihydro-1H-1,4-diazepin-7-yl]pyridin-2(1H)-one
Chemical Structure Depiction of
4,6-dimethyl-3-[5-(1,1,2,2-tetrafluoroethyl)-2,3-dihydro-1H-1,4-diazepin-7-yl]pyridin-2(1H)-one
4,6-dimethyl-3-[5-(1,1,2,2-tetrafluoroethyl)-2,3-dihydro-1H-1,4-diazepin-7-yl]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | 8016-2412 |
| Compound Name: | 4,6-dimethyl-3-[5-(1,1,2,2-tetrafluoroethyl)-2,3-dihydro-1H-1,4-diazepin-7-yl]pyridin-2(1H)-one |
| Molecular Weight: | 317.28 |
| Molecular Formula: | C14 H15 F4 N3 O |
| Smiles: | CC1=CC(C)=C(C2=CC(C(C(F)F)(F)F)=NCCN2)C(N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2285 |
| logD: | 2.204 |
| logSw: | -2.6993 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.002 |
| InChI Key: | INAZTKLQOKCKHV-UHFFFAOYSA-N |