N-cyclopentyl-1-{[(2S)-1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-{[(2S)-1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-cyclopentyl-1-{[(2S)-1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1466 |
| Compound Name: | N-cyclopentyl-1-{[(2S)-1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H29 N5 O4 |
| Smiles: | COc1cc(cc(c1)OC)C(N1CCC[C@H]1Cn1cc(C(NC2CCCC2)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3397 |
| logD: | 2.3397 |
| logSw: | -2.6064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.004 |
| InChI Key: | JTLRQYKRCFQCPR-KRWDZBQOSA-N |