6-methyl-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
Chemical Structure Depiction of
6-methyl-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
6-methyl-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0391 |
| Compound Name: | 6-methyl-2-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,3-benzoxazole |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C23 H29 N3 O3 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCN(CC1)Cc1nc2ccc(C)cc2o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8506 |
| logD: | 4.8504 |
| logSw: | -4.5492 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.237 |
| InChI Key: | GTHCUKYZLDZRKZ-UHFFFAOYSA-N |