2-{4-[2-({[4-(4-chlorophenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}-N-(3,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{4-[2-({[4-(4-chlorophenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}-N-(3,5-dimethylphenyl)acetamide
2-{4-[2-({[4-(4-chlorophenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}-N-(3,5-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | 3966-4566 |
| Compound Name: | 2-{4-[2-({[4-(4-chlorophenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}-N-(3,5-dimethylphenyl)acetamide |
| Molecular Weight: | 523.08 |
| Molecular Formula: | C29 H35 Cl N4 O3 |
| Smiles: | Cc1cc(C)cc(c1)NC(CN1CCN(CCNC=C2C(CC(CC2=O)c2ccc(cc2)[Cl])=O)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8736 |
| logD: | 3.5466 |
| logSw: | -4.558 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.029 |
| InChI Key: | DDHTTWPXCFYWGI-UHFFFAOYSA-N |