3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-{[(furan-2-yl)methyl]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-{[(furan-2-yl)methyl]amino}-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-{[(furan-2-yl)methyl]amino}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0445 |
| Compound Name: | 3-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-5-{[(furan-2-yl)methyl]amino}-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 555.03 |
| Molecular Formula: | C31 H27 Cl N4 O4 |
| Smiles: | C(c1ccco1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)CCOc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.9217 |
| logD: | 6.8996 |
| logSw: | -6.6711 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.554 |
| InChI Key: | GRWLXRSKZDDDIU-UHFFFAOYSA-N |