6-chloro-2-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
6-chloro-2-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
6-chloro-2-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0299 |
| Compound Name: | 6-chloro-2-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 445.97 |
| Molecular Formula: | C22 H24 Cl N3 O3 S |
| Smiles: | C1CCc2cc(ccc2C1)S(N1CCN(CC1)Cc1nc2ccc(cc2o1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8238 |
| logD: | 4.8237 |
| logSw: | -4.8377 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.158 |
| InChI Key: | OTYNAZVJYACUGG-UHFFFAOYSA-N |