3-(4-cyclohexylpiperazin-1-yl)-5-[4-(dimethylamino)anilino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(4-cyclohexylpiperazin-1-yl)-5-[4-(dimethylamino)anilino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(4-cyclohexylpiperazin-1-yl)-5-[4-(dimethylamino)anilino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0131 |
| Compound Name: | 3-(4-cyclohexylpiperazin-1-yl)-5-[4-(dimethylamino)anilino]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 521.66 |
| Molecular Formula: | C32 H35 N5 O2 |
| Smiles: | CN(C)c1ccc(cc1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 7.4507 |
| logD: | 7.0573 |
| logSw: | -5.9295 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.445 |
| InChI Key: | LWINAZQLHUXHJV-UHFFFAOYSA-N |