1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-3-(1H-tetrazol-1-yl)propan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-3-(1H-tetrazol-1-yl)propan-1-one
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-3-(1H-tetrazol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S823-4432 |
| Compound Name: | 1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-3-(1H-tetrazol-1-yl)propan-1-one |
| Molecular Weight: | 268.32 |
| Molecular Formula: | C11 H20 N6 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(CCn1cnnn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.609 |
| logD: | -3.3433 |
| logSw: | -0.0634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.782 |
| InChI Key: | BXMHWLHTMJLLRM-VHSXEESVSA-N |