1-({(2S,4S)-4-fluoro-1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1520 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C20 H28 F N5 O3 S |
| Smiles: | CC(C)c1ccc(cc1)S(N1C[C@H](C[C@H]1Cn1cc(C(NC(C)C)=O)nn1)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6937 |
| logD: | 2.6937 |
| logSw: | -3.0736 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.844 |
| InChI Key: | NEZUXTZBVGXPNX-SJORKVTESA-N |