2-amino-4-(2-bromophenyl)-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2-bromophenyl)-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-4-(2-bromophenyl)-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8006-8577 |
| Compound Name: | 2-amino-4-(2-bromophenyl)-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C22 H17 Br N2 O2 |
| Smiles: | C1C(CC(C2C(C(C#N)=C(N)OC1=2)c1ccccc1[Br])=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3256 |
| logD: | 4.3256 |
| logSw: | -4.6299 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.331 |
| InChI Key: | ASNQDJBULPKYDI-UHFFFAOYSA-N |