6-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
6-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
6-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0295 |
| Compound Name: | 6-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C16 H16 Cl N3 O3 S2 |
| Smiles: | C1CN(CCN1Cc1nc2ccc(cc2o1)[Cl])S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0891 |
| logD: | 3.0889 |
| logSw: | -3.4356 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.256 |
| InChI Key: | NZJRVKQIEVANCQ-UHFFFAOYSA-N |