1-{5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrol-3-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrol-3-yl}ethan-1-one
1-{5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrol-3-yl}ethan-1-one
Compound characteristics
| Compound ID: | C444-0361 |
| Compound Name: | 1-{5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrol-3-yl}ethan-1-one |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C21 H27 N3 O2 |
| Smiles: | CC(c1c(C)c(C(N2CCN(CC2)c2cc(C)ccc2C)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.54 |
| logD: | 3.54 |
| logSw: | -3.8741 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.654 |
| InChI Key: | LSZMNGIMGILNGF-UHFFFAOYSA-N |