1-{[(2S)-1-(3-chloro-4-fluorobenzoyl)pyrrolidin-2-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S)-1-(3-chloro-4-fluorobenzoyl)pyrrolidin-2-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S)-1-(3-chloro-4-fluorobenzoyl)pyrrolidin-2-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1436 |
| Compound Name: | 1-{[(2S)-1-(3-chloro-4-fluorobenzoyl)pyrrolidin-2-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 419.89 |
| Molecular Formula: | C20 H23 Cl F N5 O2 |
| Smiles: | C1CCC(C1)NC(c1cn(C[C@@H]2CCCN2C(c2ccc(c(c2)[Cl])F)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5958 |
| logD: | 2.5958 |
| logSw: | -3.5347 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.917 |
| InChI Key: | ZJNMJLSPOGIRIO-HNNXBMFYSA-N |