rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(propane-2-sulfonyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(propane-2-sulfonyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(propane-2-sulfonyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S641-0465 |
| Compound Name: | rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(propane-2-sulfonyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C11 H19 N5 O3 S |
| Smiles: | CC(C)S(N1C[C@@H](C(N)=O)[C@@H](C1)c1nc(C)n[nH]1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.7363 |
| logD: | -0.7367 |
| logSw: | -1.941 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.91 |
| InChI Key: | ZPPAHDABAAQZQC-RKDXNWHRSA-N |