6-chloro-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
Chemical Structure Depiction of
6-chloro-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
6-chloro-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0307 |
| Compound Name: | 6-chloro-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C22 H26 Cl N3 O3 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCN(CC1)Cc1nc2ccc(cc2o1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1631 |
| logD: | 5.1629 |
| logSw: | -5.5658 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.237 |
| InChI Key: | KPKJFZVUXONNDM-UHFFFAOYSA-N |