1-(4-{4-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F322-0118 |
| Compound Name: | 1-(4-{4-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C21 H23 N3 O4 S2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1c(c2ccno2)c(C)sc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7809 |
| logD: | 2.7809 |
| logSw: | -3.1436 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.924 |
| InChI Key: | OMBKFOBASQSHJD-UHFFFAOYSA-N |