N,3-dimethyl-N-[2-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Chemical Structure Depiction of
N,3-dimethyl-N-[2-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
N,3-dimethyl-N-[2-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Compound characteristics
| Compound ID: | S428-1112 |
| Compound Name: | N,3-dimethyl-N-[2-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide |
| Molecular Weight: | 533.6 |
| Molecular Formula: | C24 H31 N5 O7 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N(C)CC(N1CCC(CC1)Cc1nc(C2CCOCC2)no1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0032 |
| logD: | 2.0032 |
| logSw: | -2.9419 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.233 |
| InChI Key: | CDWVTGKXCKJBLH-UHFFFAOYSA-N |