1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-N-(prop-2-en-1-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-N-(prop-2-en-1-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-N-(prop-2-en-1-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 4781-0023 |
| Compound Name: | 1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-N-(prop-2-en-1-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C21 H21 Cl N2 O3 |
| Smiles: | CC1(C)CC2=C(C=C(C(NCC=C)=O)C(N2c2ccc(cc2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5072 |
| logD: | 2.5068 |
| logSw: | -3.3432 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.106 |
| InChI Key: | BIBHJKFLDXZABM-UHFFFAOYSA-N |