1-(4-{4-[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F322-0904 |
| Compound Name: | 1-(4-{4-[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 473.61 |
| Molecular Formula: | C23 H27 N3 O4 S2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1c(c2c(C)c(C)no2)c(C)sc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8486 |
| logD: | 3.8486 |
| logSw: | -4.2261 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.4 |
| InChI Key: | NIHCWLCYUCBPJZ-UHFFFAOYSA-N |