N-[(2,5-dimethoxyphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G305-1096 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C22 H25 N3 O7 S |
| Smiles: | COc1ccc(c(CNC(C2CCN(CC2)S(c2ccc3c(c2)OC(N3)=O)(=O)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.9699 |
| logD: | 1.9363 |
| logSw: | -2.8468 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.955 |
| InChI Key: | NTKVYVBGMXHTJG-UHFFFAOYSA-N |