N-{2-[(2-methoxyethyl)amino]-1-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(2-methoxyethyl)amino]-1-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[(2-methoxyethyl)amino]-1-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V003-8035 |
| Compound Name: | N-{2-[(2-methoxyethyl)amino]-1-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C25 H31 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(C(NCCOC)=O)NC(c1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6964 |
| logD: | 2.6964 |
| logSw: | -3.2284 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.699 |
| InChI Key: | AYNPBWFBJXFABY-QHCPKHFHSA-N |