1-(4-{4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F176-0511 |
| Compound Name: | 1-(4-{4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C24 H27 N3 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1cc(ccc1C)c1c(C)noc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4988 |
| logD: | 3.4988 |
| logSw: | -3.9569 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.803 |
| InChI Key: | YFADAKSRRZKBKN-UHFFFAOYSA-N |