5-(benzylamino)-3-{4-[(1,3-dihydro-2-benzofuran-5-yl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(benzylamino)-3-{4-[(1,3-dihydro-2-benzofuran-5-yl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(benzylamino)-3-{4-[(1,3-dihydro-2-benzofuran-5-yl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0392 |
| Compound Name: | 5-(benzylamino)-3-{4-[(1,3-dihydro-2-benzofuran-5-yl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 542.64 |
| Molecular Formula: | C34 H30 N4 O3 |
| Smiles: | C(c1ccccc1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)Cc1ccc2COCc2c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1141 |
| logD: | 5.7915 |
| logSw: | -6.2033 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.601 |
| InChI Key: | JCTBMXOWXJQTMW-UHFFFAOYSA-N |