N-cyclopentyl-1-{[(2S)-1-(4-ethoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-{[(2S)-1-(4-ethoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-cyclopentyl-1-{[(2S)-1-(4-ethoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1507 |
| Compound Name: | N-cyclopentyl-1-{[(2S)-1-(4-ethoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C21 H29 N5 O4 S |
| Smiles: | CCOc1ccc(cc1)S(N1CCC[C@H]1Cn1cc(C(NC2CCCC2)=O)nn1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.545 |
| logD: | 2.545 |
| logSw: | -2.707 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.88 |
| InChI Key: | QXUIATHSNNVCEC-KRWDZBQOSA-N |