N-[(3S,5S)-1-(3,5-difluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3,5-difluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-(3,5-difluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-1020 |
| Compound Name: | N-[(3S,5S)-1-(3,5-difluorobenzene-1-sulfonyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 447.46 |
| Molecular Formula: | C20 H19 F2 N5 O3 S |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2S(c2cc(cc(c2)F)F)(=O)=O)NC(c2ccccc2)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 2.3213 |
| logD: | 2.3199 |
| logSw: | -2.9005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.064 |
| InChI Key: | HALFCRDOQRUXKF-AEFFLSMTSA-N |