1-{[(2S,4S)-4-fluoro-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-4-fluoro-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1335 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C18 H22 F N5 O3 S |
| Smiles: | C1CCc2cc(ccc2C1)S(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.7615 |
| logD: | 1.7615 |
| logSw: | -2.5824 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.165 |
| InChI Key: | OQXNLEWPNIRBKM-CABCVRRESA-N |