2-{[4-(3,4-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
2-{[4-(3,4-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
2-{[4-(3,4-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | G373-2482 |
| Compound Name: | 2-{[4-(3,4-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 426.32 |
| Molecular Formula: | C18 H17 Cl2 N3 O3 S |
| Smiles: | C1CN(CCN1Cc1nc2ccccc2o1)S(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1225 |
| logD: | 4.1223 |
| logSw: | -4.2847 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.237 |
| InChI Key: | NJHXJSCTYAMGMW-UHFFFAOYSA-N |