5-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
5-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
5-chloro-2-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0128 |
| Compound Name: | 5-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(CCN1Cc1nc2cc(ccc2o1)[Cl])S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9242 |
| logD: | 2.924 |
| logSw: | -3.3975 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.256 |
| InChI Key: | KHGNQRJFJVAJBP-UHFFFAOYSA-N |