3-{5-[(dimethylamino)methyl]-1H-tetrazol-1-yl}benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{5-[(dimethylamino)methyl]-1H-tetrazol-1-yl}benzoic acid--hydrogen chloride (1/1)
3-{5-[(dimethylamino)methyl]-1H-tetrazol-1-yl}benzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-4321 |
| Compound Name: | 3-{5-[(dimethylamino)methyl]-1H-tetrazol-1-yl}benzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 283.71 |
| Molecular Formula: | C11 H13 N5 O2 |
| Salt: | HCl |
| Smiles: | CN(C)Cc1nnnn1c1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6039 |
| logD: | -3.514 |
| logSw: | -1.4163 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.85 |
| InChI Key: | VQOWHMJEMIYRHO-UHFFFAOYSA-N |