4-[4-(propan-2-yl)benzene-1-sulfonyl]-3-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperazin-2-one
Chemical Structure Depiction of
4-[4-(propan-2-yl)benzene-1-sulfonyl]-3-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperazin-2-one
4-[4-(propan-2-yl)benzene-1-sulfonyl]-3-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperazin-2-one
Compound characteristics
| Compound ID: | SD12-0339 |
| Compound Name: | 4-[4-(propan-2-yl)benzene-1-sulfonyl]-3-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperazin-2-one |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C21 H23 N5 O4 S |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCNC(C1Cc1nc(c2ccncc2)no1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8555 |
| logD: | 2.8555 |
| logSw: | -3.208 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.776 |
| InChI Key: | ZEPAVJYWKQBYIC-SFHVURJKSA-N |