3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0352 |
| Compound Name: | 3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 519 |
| Molecular Formula: | C28 H27 Cl N4 O4 |
| Smiles: | C(CO)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)CCOc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2443 |
| logD: | 5.2222 |
| logSw: | -5.6254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.574 |
| InChI Key: | MKEQDTJCZVZROT-UHFFFAOYSA-N |