2-(1-{4-[2-({[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}ethylidene)-1H-indene-1,3(2H)-dione
Chemical Structure Depiction of
2-(1-{4-[2-({[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}ethylidene)-1H-indene-1,3(2H)-dione
2-(1-{4-[2-({[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}ethylidene)-1H-indene-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4038-0150 |
| Compound Name: | 2-(1-{4-[2-({[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}ethylidene)-1H-indene-1,3(2H)-dione |
| Molecular Weight: | 511.62 |
| Molecular Formula: | C31 H33 N3 O4 |
| Smiles: | CC(=C1C(c2ccccc2C1=O)=O)N1CCN(CCNC=C2C(CC(CC2=O)c2ccc(C)cc2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.0752 |
| logD: | 3.0227 |
| logSw: | -3.5887 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.737 |
| InChI Key: | FJMQGYXVJXPHJE-UHFFFAOYSA-N |