N-{2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Chemical Structure Depiction of
N-{2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
N-{2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline
Compound characteristics
| Compound ID: | J034-1126 |
| Compound Name: | N-{2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]butan-2-yl}aniline |
| Molecular Weight: | 327.81 |
| Molecular Formula: | C17 H18 Cl N5 |
| Smiles: | CCC(C)(c1nnnn1c1ccc(cc1)[Cl])Nc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.504 |
| logD: | 4.504 |
| logSw: | -4.5787 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.293 |
| InChI Key: | CCMOLWOZSKYRLL-KRWDZBQOSA-N |