4-chloro-N-{2-[1-(3,4-dimethoxyphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Chemical Structure Depiction of
4-chloro-N-{2-[1-(3,4-dimethoxyphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
4-chloro-N-{2-[1-(3,4-dimethoxyphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Compound characteristics
| Compound ID: | J034-0043 |
| Compound Name: | 4-chloro-N-{2-[1-(3,4-dimethoxyphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline |
| Molecular Weight: | 387.87 |
| Molecular Formula: | C19 H22 Cl N5 O2 |
| Smiles: | CCC(C)(c1nnnn1c1ccc(c(c1)OC)OC)Nc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3484 |
| logD: | 4.3484 |
| logSw: | -4.5396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.554 |
| InChI Key: | OVXWCIACCOJTOY-IBGZPJMESA-N |