2,4-diamino-5-[4-(dimethylamino)phenyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydro-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2,4-diamino-5-[4-(dimethylamino)phenyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydro-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
2,4-diamino-5-[4-(dimethylamino)phenyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydro-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8017-6208 |
| Compound Name: | 2,4-diamino-5-[4-(dimethylamino)phenyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydro-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C23 H25 N5 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)N(C)C)c3c(c(C#N)c(N)nc3O2)N)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9147 |
| logD: | 2.9077 |
| logSw: | -3.407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 89.568 |
| InChI Key: | ZXLCQZLFOSAPPF-QGZVFWFLSA-N |