N-{4-[(3-amino-1,4-dioxo-1,4-dihydronaphthalen-2-yl)sulfanyl]phenyl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{4-[(3-amino-1,4-dioxo-1,4-dihydronaphthalen-2-yl)sulfanyl]phenyl}cyclopropanecarboxamide
N-{4-[(3-amino-1,4-dioxo-1,4-dihydronaphthalen-2-yl)sulfanyl]phenyl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | C301-9694 |
| Compound Name: | N-{4-[(3-amino-1,4-dioxo-1,4-dihydronaphthalen-2-yl)sulfanyl]phenyl}cyclopropanecarboxamide |
| Molecular Weight: | 364.42 |
| Molecular Formula: | C20 H16 N2 O3 S |
| Smiles: | C1CC1C(Nc1ccc(cc1)SC1=C(C(c2ccccc2C1=O)=O)N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2492 |
| logD: | 3.2492 |
| logSw: | -4.0666 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.902 |
| InChI Key: | XIYKPGJVIVZZCH-UHFFFAOYSA-N |