N-benzyl-1-{[(2S)-1-(1-methyl-1H-pyrazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-{[(2S)-1-(1-methyl-1H-pyrazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-{[(2S)-1-(1-methyl-1H-pyrazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1069 |
| Compound Name: | N-benzyl-1-{[(2S)-1-(1-methyl-1H-pyrazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 393.45 |
| Molecular Formula: | C20 H23 N7 O2 |
| Smiles: | Cn1ccc(C(N2CCC[C@H]2Cn2cc(C(NCc3ccccc3)=O)nn2)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | 0.6107 |
| logD: | 0.6107 |
| logSw: | -1.5275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.518 |
| InChI Key: | SGTOIDCKAGJLDT-INIZCTEOSA-N |