6-amino-8-(3-iodophenyl)-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
Chemical Structure Depiction of
6-amino-8-(3-iodophenyl)-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
6-amino-8-(3-iodophenyl)-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
Compound characteristics
| Compound ID: | 8020-6614 |
| Compound Name: | 6-amino-8-(3-iodophenyl)-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile |
| Molecular Weight: | 418.19 |
| Molecular Formula: | C17 H11 I N2 O3 |
| Smiles: | C1Oc2cc3C(C(C#N)=C(N)Oc3cc2O1)c1cccc(c1)I |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5392 |
| logD: | 3.5391 |
| logSw: | -3.6954 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.409 |
| InChI Key: | VNKXVODXGZPQMS-INIZCTEOSA-N |