4,6-dimethyl-3-[7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepin-5-yl]pyridin-2(1H)-one
Chemical Structure Depiction of
4,6-dimethyl-3-[7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepin-5-yl]pyridin-2(1H)-one
4,6-dimethyl-3-[7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepin-5-yl]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | 8017-4127 |
| Compound Name: | 4,6-dimethyl-3-[7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepin-5-yl]pyridin-2(1H)-one |
| Molecular Weight: | 285.27 |
| Molecular Formula: | C13 H14 F3 N3 O |
| Smiles: | CC1=CC(C)=C(C2C=C(C(F)(F)F)NCCN=2)C(N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0653 |
| logD: | 1.2213 |
| logSw: | -2.6101 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.002 |
| InChI Key: | MTFIXGAFYWKBSO-UHFFFAOYSA-N |