2-(benzylamino)-3-chloro-5-hydroxynaphthalene-1,4-dione
Chemical Structure Depiction of
2-(benzylamino)-3-chloro-5-hydroxynaphthalene-1,4-dione
2-(benzylamino)-3-chloro-5-hydroxynaphthalene-1,4-dione
Compound characteristics
Compound ID: | 8020-6199 |
Compound Name: | 2-(benzylamino)-3-chloro-5-hydroxynaphthalene-1,4-dione |
Molecular Weight: | 313.74 |
Molecular Formula: | C17 H12 Cl N O3 |
Smiles: | C(c1ccccc1)NC1=C(C(c2c(cccc2O)C1=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.5048 |
logD: | 3.4645 |
logSw: | -3.7733 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.434 |
InChI Key: | DJAYGPIZAXJDMJ-UHFFFAOYSA-N |