N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[4-(1H-indol-3-yl)butanoyl]piperidin-3-yl}benzamide
Chemical Structure Depiction of
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[4-(1H-indol-3-yl)butanoyl]piperidin-3-yl}benzamide
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[4-(1H-indol-3-yl)butanoyl]piperidin-3-yl}benzamide
Compound characteristics
| Compound ID: | S617-0545 |
| Compound Name: | N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[4-(1H-indol-3-yl)butanoyl]piperidin-3-yl}benzamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C25 H29 N3 O3 |
| Smiles: | C(CC(N1CC[C@H](CO)[C@@H](C1)NC(c1ccccc1)=O)=O)Cc1c[nH]c2ccccc12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.499 |
| logD: | 2.499 |
| logSw: | -2.5731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.615 |
| InChI Key: | KACVHGWWDACHNX-REWPJTCUSA-N |