3-ethyl-4,8-dimethyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-ethyl-4,8-dimethyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
3-ethyl-4,8-dimethyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-0992 |
| Compound Name: | 3-ethyl-4,8-dimethyl-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 300.31 |
| Molecular Formula: | C15 H16 N4 O3 |
| Smiles: | CCC1=C(C)c2ccc(c(C)c2OC1=O)OCc1nnn[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.5159 |
| logD: | 0.4612 |
| logSw: | -2.9476 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.534 |
| InChI Key: | WBPRHGHKXQDSNC-UHFFFAOYSA-N |