N-{2-[2-(3,4-dimethylanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{2-[2-(3,4-dimethylanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-methoxybenzamide
N-{2-[2-(3,4-dimethylanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | 8019-1103 |
| Compound Name: | N-{2-[2-(3,4-dimethylanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-methoxybenzamide |
| Molecular Weight: | 542.52 |
| Molecular Formula: | C27 H28 F6 N2 O3 |
| Smiles: | Cc1ccc(cc1C)NC1CC(C)(C)CC(C=1C(C(F)(F)F)(C(F)(F)F)NC(c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9497 |
| logD: | -2.5275 |
| logSw: | -5.6998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.748 |
| InChI Key: | HRDPIDFCUQDZEX-UHFFFAOYSA-N |