N-benzyl-1-({(2S)-1-[(thiophen-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(thiophen-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(thiophen-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0201 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(thiophen-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C20 H23 N5 O S |
| Smiles: | C1C[C@@H](Cn2cc(C(NCc3ccccc3)=O)nn2)N(C1)Cc1ccsc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.4975 |
| logD: | 1.8669 |
| logSw: | -2.5053 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.094 |
| InChI Key: | FORMJKGLVJHHEM-SFHVURJKSA-N |