N-[rel-(3R,4S)-1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopentanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopentanecarboxamide
N-[rel-(3R,4S)-1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopentanecarboxamide
Compound characteristics
| Compound ID: | SB33-0130 |
| Compound Name: | N-[rel-(3R,4S)-1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopentanecarboxamide |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C19 H29 N7 O |
| Smiles: | CCn1cc(CN2C[C@H]([C@@H](C2)c2nc(C)n[nH]2)NC(C2CCCC2)=O)cn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5118 |
| logD: | -5.8704 |
| logSw: | -1.7421 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.998 |
| InChI Key: | NKAJHCWIKIZYDJ-IRXDYDNUSA-N |