N-{[rel-(3R,4S)-1-(2,3-dihydro-1H-indene-5-sulfonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
Chemical Structure Depiction of
N-{[rel-(3R,4S)-1-(2,3-dihydro-1H-indene-5-sulfonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
N-{[rel-(3R,4S)-1-(2,3-dihydro-1H-indene-5-sulfonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S618-0841 |
| Compound Name: | N-{[rel-(3R,4S)-1-(2,3-dihydro-1H-indene-5-sulfonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide |
| Molecular Weight: | 379.52 |
| Molecular Formula: | C19 H29 N3 O3 S |
| Smiles: | CC(NC[C@H]1CCN(C[C@H]1N(C)C)S(c1ccc2CCCc2c1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4914 |
| logD: | 1.1571 |
| logSw: | -2.4506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.665 |
| InChI Key: | HMLQLSZGCIXLLU-MJGOQNOKSA-N |