3-ethyl-4-methyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-ethyl-4-methyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
3-ethyl-4-methyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-1003 |
| Compound Name: | 3-ethyl-4-methyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 286.29 |
| Molecular Formula: | C14 H14 N4 O3 |
| Smiles: | CCC1=C(C)c2ccc(cc2OC1=O)OCc1nnn[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.9408 |
| logD: | -0.114 |
| logSw: | -2.7926 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.762 |
| InChI Key: | SEQASOHIHVJODJ-UHFFFAOYSA-N |