2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8016-0641 |
| Compound Name: | 2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 303.38 |
| Molecular Formula: | C14 H17 N5 O S |
| Smiles: | CSc1ccc(cc1)c1nnn(CC(N2CCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2489 |
| logD: | 2.2489 |
| logSw: | -2.5148 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.1 |
| InChI Key: | IJBCKJNPCXHHAM-UHFFFAOYSA-N |