1-{[(2S)-4,4-difluoro-1-(1H-indole-6-carbonyl)pyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S)-4,4-difluoro-1-(1H-indole-6-carbonyl)pyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S)-4,4-difluoro-1-(1H-indole-6-carbonyl)pyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0106 |
| Compound Name: | 1-{[(2S)-4,4-difluoro-1-(1H-indole-6-carbonyl)pyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 388.37 |
| Molecular Formula: | C18 H18 F2 N6 O2 |
| Smiles: | CNC(c1cn(C[C@@H]2CC(CN2C(c2ccc3cc[nH]c3c2)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.2255 |
| logD: | 1.2255 |
| logSw: | -2.4065 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.962 |
| InChI Key: | QNPDUBBUDIJQCZ-CYBMUJFWSA-N |