2-{[4-(4-cyclohexylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-5-methyl-1,3-benzoxazole
Chemical Structure Depiction of
2-{[4-(4-cyclohexylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-5-methyl-1,3-benzoxazole
2-{[4-(4-cyclohexylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-5-methyl-1,3-benzoxazole
Compound characteristics
| Compound ID: | F874-0209 |
| Compound Name: | 2-{[4-(4-cyclohexylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-5-methyl-1,3-benzoxazole |
| Molecular Weight: | 453.6 |
| Molecular Formula: | C25 H31 N3 O3 S |
| Smiles: | Cc1ccc2c(c1)nc(CN1CCN(CC1)S(c1ccc(cc1)C1CCCCC1)(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.4414 |
| logD: | 5.4412 |
| logSw: | -5.2939 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.158 |
| InChI Key: | VCNOMZHFKNTZKX-UHFFFAOYSA-N |