4-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzene-1-sulfonyl)piperidine
4-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | M354-0243 |
| Compound Name: | 4-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 496 |
| Molecular Formula: | C21 H22 Cl N3 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)c1nc(CS(c2ccc(cc2)[Cl])(=O)=O)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0778 |
| logD: | 4.0778 |
| logSw: | -4.3981 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 93.382 |
| InChI Key: | GYSMYVLUZPTZOR-UHFFFAOYSA-N |