[4-(2,5-dimethylphenyl)piperazin-1-yl]{5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
[4-(2,5-dimethylphenyl)piperazin-1-yl]{5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-yl}methanone
[4-(2,5-dimethylphenyl)piperazin-1-yl]{5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | C521-0823 |
| Compound Name: | [4-(2,5-dimethylphenyl)piperazin-1-yl]{5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C25 H28 N2 O4 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc(CS(c2ccccc2C)(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8634 |
| logD: | 4.8634 |
| logSw: | -4.6193 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.452 |
| InChI Key: | UYFFBNARAWZARA-UHFFFAOYSA-N |