2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-3681 |
| Compound Name: | 2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile |
| Molecular Weight: | 389.2 |
| Molecular Formula: | C17 H13 Br N2 O4 |
| Smiles: | CC1=CC2=C(C(C(C#N)=C(N)O2)c2cc(ccc2OC)[Br])C(=O)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7312 |
| logD: | 2.7312 |
| logSw: | -3.2277 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.519 |
| InChI Key: | OYYGOMYTXVQRIC-CQSZACIVSA-N |