rel-(3R,4S)-1-benzyl-4-{[(5-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-{[(5-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-{[(5-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S837-1381 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-{[(5-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | Cc1c(CNC([C@H]2CN(Cc3ccccc3)C[C@H]2C(O)=O)=O)cn[nH]1 |
| Stereo: | RELATIVE |
| logP: | 0.4146 |
| logD: | 0.4146 |
| logSw: | -2.0611 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.293 |
| InChI Key: | BCQMCMHIVDYMJM-CVEARBPZSA-N |