N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-phenylacetamide
Chemical Structure Depiction of
N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-phenylacetamide
N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-phenylacetamide
Compound characteristics
| Compound ID: | 8019-0980 |
| Compound Name: | N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-phenylacetamide |
| Molecular Weight: | 586.57 |
| Molecular Formula: | C29 H32 F6 N2 O4 |
| Smiles: | CC1(C)CC(=C(C(C1)=O)C(C(F)(F)F)(C(F)(F)F)NC(Cc1ccccc1)=O)NCCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9442 |
| logD: | -3.643 |
| logSw: | -4.7591 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.415 |
| InChI Key: | QKAHTLCNHOIBMN-UHFFFAOYSA-N |