7-methoxy-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carbonitrile
Chemical Structure Depiction of
7-methoxy-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carbonitrile
7-methoxy-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8020-7090 |
| Compound Name: | 7-methoxy-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carbonitrile |
| Molecular Weight: | 190.15 |
| Molecular Formula: | C9 H6 N2 O3 |
| Smiles: | COc1cc(C#N)cc2c1OC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.241 |
| logD: | 1.235 |
| logSw: | -2.0958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.027 |
| InChI Key: | ZYMWJQINBFEONM-UHFFFAOYSA-N |