N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-0583 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 523.61 |
| Molecular Formula: | C27 H29 N3 O6 S |
| Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(Nc2ccc3c(c2)OCCO3)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9442 |
| logD: | 2.944 |
| logSw: | -3.3414 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.379 |
| InChI Key: | NTWBKNMBRNBCTR-UHFFFAOYSA-N |