6-{4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
6-{4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S429-1173 |
| Compound Name: | 6-{4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 529.61 |
| Molecular Formula: | C25 H31 N5 O6 S |
| Smiles: | CC1(CCN(CC1)C(C1CCN(CC1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O)c1nc(C2CC2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.8285 |
| logD: | 2.8285 |
| logSw: | -3.4696 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 103.393 |
| InChI Key: | NNJIBNCZKRJCPJ-UHFFFAOYSA-N |