2-{4-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]piperidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
2-{4-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]piperidine-1-sulfonyl}benzonitrile
2-{4-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]piperidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | D153-0025 |
| Compound Name: | 2-{4-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]piperidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C20 H20 N6 O3 S |
| Smiles: | COc1ccc(cc1)n1c(C2CCN(CC2)S(c2ccccc2C#N)(=O)=O)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 2.5924 |
| logD: | 2.5924 |
| logSw: | -3.1739 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 95.618 |
| InChI Key: | YMJOBOMIOXJBFL-UHFFFAOYSA-N |