1-[rel-(3R,4S)-3-[(cyclopropylmethoxy)methyl]-4-(pyridin-4-yl)pyrrolidin-1-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-[(cyclopropylmethoxy)methyl]-4-(pyridin-4-yl)pyrrolidin-1-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
1-[rel-(3R,4S)-3-[(cyclopropylmethoxy)methyl]-4-(pyridin-4-yl)pyrrolidin-1-yl]-2-(1H-tetrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S824-2914 |
| Compound Name: | 1-[rel-(3R,4S)-3-[(cyclopropylmethoxy)methyl]-4-(pyridin-4-yl)pyrrolidin-1-yl]-2-(1H-tetrazol-1-yl)ethan-1-one |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C17 H22 N6 O2 |
| Smiles: | C1CC1COC[C@@H]1CN(C[C@H]1c1ccncc1)C(Cn1cnnn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6532 |
| logD: | 0.5459 |
| logSw: | -1.5086 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.62 |
| InChI Key: | VMDMWVVXYARQDW-HOTGVXAUSA-N |