6-chloro-7-(4-methylanilino)-5,8-dioxo-5,8-dihydronaphthalene-1,4-diyl diacetate
Chemical Structure Depiction of
6-chloro-7-(4-methylanilino)-5,8-dioxo-5,8-dihydronaphthalene-1,4-diyl diacetate
6-chloro-7-(4-methylanilino)-5,8-dioxo-5,8-dihydronaphthalene-1,4-diyl diacetate
Compound characteristics
| Compound ID: | 8020-5337 |
| Compound Name: | 6-chloro-7-(4-methylanilino)-5,8-dioxo-5,8-dihydronaphthalene-1,4-diyl diacetate |
| Molecular Weight: | 413.81 |
| Molecular Formula: | C21 H16 Cl N O6 |
| Smiles: | CC(=O)Oc1ccc(c2C(C(=C(C(c12)=O)Nc1ccc(C)cc1)[Cl])=O)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2041 |
| logD: | 3.2018 |
| logSw: | -3.9915 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.239 |
| InChI Key: | DWNOGVKYYOSQRK-UHFFFAOYSA-N |