1,3-diamino-10-(3-bromophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
Chemical Structure Depiction of
1,3-diamino-10-(3-bromophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
1,3-diamino-10-(3-bromophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
Compound characteristics
| Compound ID: | 8020-3563 |
| Compound Name: | 1,3-diamino-10-(3-bromophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile |
| Molecular Weight: | 411.26 |
| Molecular Formula: | C19 H15 Br N4 O2 |
| Smiles: | C1CC2=C(C(c3cccc(c3)[Br])c3c(c(C#N)c(N)nc3N)O2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8174 |
| logD: | 2.8174 |
| logSw: | -3.4528 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 86.839 |
| InChI Key: | UASAQVJTTCBZJM-CQSZACIVSA-N |