2-amino-7-hydroxy-4-(pentan-3-yl)-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-7-hydroxy-4-(pentan-3-yl)-4H-1-benzopyran-3-carbonitrile
2-amino-7-hydroxy-4-(pentan-3-yl)-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-7958 |
| Compound Name: | 2-amino-7-hydroxy-4-(pentan-3-yl)-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 258.32 |
| Molecular Formula: | C15 H18 N2 O2 |
| Smiles: | CCC(CC)C1C(C#N)=C(N)Oc2cc(ccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8023 |
| logD: | 2.802 |
| logSw: | -3.0122 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.182 |
| InChI Key: | KQFQGCIMMWCKAR-CQSZACIVSA-N |