rel-(3R,4S)-1-benzyl-N-methyl-4-[3-(1H-tetrazol-1-yl)propanamido]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-N-methyl-4-[3-(1H-tetrazol-1-yl)propanamido]pyrrolidine-3-carboxamide
rel-(3R,4S)-1-benzyl-N-methyl-4-[3-(1H-tetrazol-1-yl)propanamido]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S963-2663 |
| Compound Name: | rel-(3R,4S)-1-benzyl-N-methyl-4-[3-(1H-tetrazol-1-yl)propanamido]pyrrolidine-3-carboxamide |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C17 H23 N7 O2 |
| Smiles: | CNC([C@H]1CN(Cc2ccccc2)C[C@@H]1NC(CCn1cnnn1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.5845 |
| logD: | -2.0857 |
| logSw: | -1.9658 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.326 |
| InChI Key: | OQLFBWOMTOSPQA-GJZGRUSLSA-N |