N-benzyl-1-({(2S)-4,4-difluoro-1-[(1H-imidazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-4,4-difluoro-1-[(1H-imidazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-4,4-difluoro-1-[(1H-imidazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0825 |
| Compound Name: | N-benzyl-1-({(2S)-4,4-difluoro-1-[(1H-imidazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 429.43 |
| Molecular Formula: | C20 H21 F2 N7 O2 |
| Smiles: | C1[C@@H](Cn2cc(C(NCc3ccccc3)=O)nn2)N(CC1(F)F)C(Cn1ccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.577 |
| logD: | 0.4132 |
| logSw: | -1.2591 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.054 |
| InChI Key: | DZNOBMDQNQFFAK-MRXNPFEDSA-N |