(1-{[(2S)-4,4-difluoro-1-(1-methyl-1H-imidazole-4-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-4,4-difluoro-1-(1-methyl-1H-imidazole-4-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S)-4,4-difluoro-1-(1-methyl-1H-imidazole-4-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-0597 |
| Compound Name: | (1-{[(2S)-4,4-difluoro-1-(1-methyl-1H-imidazole-4-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C16 H21 F2 N7 O3 S |
| Smiles: | Cn1cc(nc1)S(N1CC(C[C@H]1Cn1cc(C(N2CCCC2)=O)nn1)(F)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.0277 |
| logD: | -0.0277 |
| logSw: | -1.4452 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.611 |
| InChI Key: | FVTPSDRVTVZYLT-LBPRGKRZSA-N |