N-(1-benzylpiperidin-4-yl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
N-(1-benzylpiperidin-4-yl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | E589-4839 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | C1CN(CCC1NC(CCNS(c1ccc2c(C=CC(N2)=O)c1)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0954 |
| logD: | 0.5377 |
| logSw: | -2.9396 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.396 |
| InChI Key: | LXVYSRZGJVMVLW-UHFFFAOYSA-N |