4-chloro-N-{2-[1-(3-methylphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Chemical Structure Depiction of
4-chloro-N-{2-[1-(3-methylphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
4-chloro-N-{2-[1-(3-methylphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Compound characteristics
| Compound ID: | J034-1894 |
| Compound Name: | 4-chloro-N-{2-[1-(3-methylphenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline |
| Molecular Weight: | 341.84 |
| Molecular Formula: | C18 H20 Cl N5 |
| Smiles: | CCC(C)(c1nnnn1c1cccc(C)c1)Nc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1891 |
| logD: | 5.1891 |
| logSw: | -5.5703 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.293 |
| InChI Key: | DOWHAWCSIFGUHF-SFHVURJKSA-N |