[2-amino-3-cyano-7-(furan-2-yl)-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl]acetic acid
Chemical Structure Depiction of
[2-amino-3-cyano-7-(furan-2-yl)-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl]acetic acid
[2-amino-3-cyano-7-(furan-2-yl)-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl]acetic acid
Compound characteristics
| Compound ID: | 8011-9731 |
| Compound Name: | [2-amino-3-cyano-7-(furan-2-yl)-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl]acetic acid |
| Molecular Weight: | 431.4 |
| Molecular Formula: | C23 H17 N3 O6 |
| Smiles: | C1C(CC(C2=C1OC(=C(C#N)C21C(N(CC(O)=O)c2ccccc12)=O)N)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7935 |
| logD: | -3.4829 |
| logSw: | -2.1028 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.033 |
| InChI Key: | YVMJYSFFJGPXOS-UHFFFAOYSA-N |