rel-(3R,4S)-3-benzamido-N,N-diethyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-3-benzamido-N,N-diethyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
rel-(3R,4S)-3-benzamido-N,N-diethyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB33-0284 |
| Compound Name: | rel-(3R,4S)-3-benzamido-N,N-diethyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C19 H26 N6 O2 |
| Smiles: | CCN(CC)C(N1C[C@H]([C@@H](C1)c1nc(C)n[nH]1)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4911 |
| logD: | 1.4906 |
| logSw: | -2.3 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.943 |
| InChI Key: | YVSOERVZHNDXRW-HZPDHXFCSA-N |