N-[(3S,5S)-1-(3-fluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3-fluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-(3-fluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-1012 |
| Compound Name: | N-[(3S,5S)-1-(3-fluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C20 H20 F N5 O3 S |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2S(c2cccc(c2)F)(=O)=O)NC(c2ccccc2)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 2.1598 |
| logD: | 2.1584 |
| logSw: | -2.8281 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.064 |
| InChI Key: | XSMNNXUSAURCHO-AEFFLSMTSA-N |