4-amino-7,7-dimethyl-1,3-dioxo-1,6,7,9-tetrahydro-3H-furo[3,4-h][2]benzopyran-5-carbonitrile
Chemical Structure Depiction of
4-amino-7,7-dimethyl-1,3-dioxo-1,6,7,9-tetrahydro-3H-furo[3,4-h][2]benzopyran-5-carbonitrile
4-amino-7,7-dimethyl-1,3-dioxo-1,6,7,9-tetrahydro-3H-furo[3,4-h][2]benzopyran-5-carbonitrile
Compound characteristics
| Compound ID: | 8006-0942 |
| Compound Name: | 4-amino-7,7-dimethyl-1,3-dioxo-1,6,7,9-tetrahydro-3H-furo[3,4-h][2]benzopyran-5-carbonitrile |
| Molecular Weight: | 272.26 |
| Molecular Formula: | C14 H12 N2 O4 |
| Smiles: | CC1(C)Cc2c(CO1)c1C(=O)OC(c1c(c2C#N)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.403 |
| logD: | 1.403 |
| logSw: | -1.066 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.423 |
| InChI Key: | HIFPDOZLKICRAD-UHFFFAOYSA-N |