N-benzyl-1-({(2S)-1-[(3-chlorophenyl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(3-chlorophenyl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(3-chlorophenyl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1001 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(3-chlorophenyl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 409.92 |
| Molecular Formula: | C22 H24 Cl N5 O |
| Smiles: | C1C[C@@H](Cn2cc(C(NCc3ccccc3)=O)nn2)N(C1)Cc1cccc(c1)[Cl] |
| Stereo: | ABSOLUTE |
| logP: | 3.4402 |
| logD: | 3.3707 |
| logSw: | -3.7307 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.075 |
| InChI Key: | MMTICOUJIVVHDE-FQEVSTJZSA-N |