N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-2H-1,3-benzodioxol-5-amine
Chemical Structure Depiction of
N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-2H-1,3-benzodioxol-5-amine
N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-2H-1,3-benzodioxol-5-amine
Compound characteristics
| Compound ID: | J034-0655 |
| Compound Name: | N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-2H-1,3-benzodioxol-5-amine |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C20 H23 N5 O2 |
| Smiles: | CCC(C)(c1nnnn1c1c(C)cccc1C)Nc1ccc2c(c1)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6438 |
| logD: | 4.6438 |
| logSw: | -4.4339 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.807 |
| InChI Key: | ZTALYESNBOSAFY-FQEVSTJZSA-N |