5-tert-butyl-2-{[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Chemical Structure Depiction of
5-tert-butyl-2-{[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
5-tert-butyl-2-{[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole
Compound characteristics
| Compound ID: | G373-4137 |
| Compound Name: | 5-tert-butyl-2-{[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,3-benzoxazole |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C22 H26 Cl N3 O3 S |
| Smiles: | CC(C)(C)c1ccc2c(c1)nc(CN1CCN(CC1)S(c1cccc(c1)[Cl])(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.8796 |
| logD: | 4.8795 |
| logSw: | -4.8856 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.237 |
| InChI Key: | SWAKBSFUJMXETL-UHFFFAOYSA-N |