3-(4-chlorophenyl)-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
3-(4-chlorophenyl)-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-1022 |
| Compound Name: | 3-(4-chlorophenyl)-7-[(1H-tetrazol-5-yl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 354.75 |
| Molecular Formula: | C17 H11 Cl N4 O3 |
| Smiles: | C(c1nnn[nH]1)Oc1ccc2C=C(C(=O)Oc2c1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9877 |
| logD: | 0.9329 |
| logSw: | -3.8235 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.491 |
| InChI Key: | LFHNLGLENDIBGO-UHFFFAOYSA-N |