4-{acetyl[1,4-dioxo-3-(pyrrolidin-1-yl)-1,4-dihydronaphthalen-2-yl]amino}benzoic acid
Chemical Structure Depiction of
4-{acetyl[1,4-dioxo-3-(pyrrolidin-1-yl)-1,4-dihydronaphthalen-2-yl]amino}benzoic acid
4-{acetyl[1,4-dioxo-3-(pyrrolidin-1-yl)-1,4-dihydronaphthalen-2-yl]amino}benzoic acid
Compound characteristics
| Compound ID: | 4204-0078 |
| Compound Name: | 4-{acetyl[1,4-dioxo-3-(pyrrolidin-1-yl)-1,4-dihydronaphthalen-2-yl]amino}benzoic acid |
| Molecular Weight: | 404.42 |
| Molecular Formula: | C23 H20 N2 O5 |
| Smiles: | CC(N(C1=C(C(c2ccccc2C1=O)=O)N1CCCC1)c1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4008 |
| logD: | 1.0056 |
| logSw: | -3.6732 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.125 |
| InChI Key: | GGMXYIHUHNPKHT-UHFFFAOYSA-N |