5-[(2H-1,3-benzodioxol-5-yl)amino]-3-[4-(4-methoxyphenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)amino]-3-[4-(4-methoxyphenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-[(2H-1,3-benzodioxol-5-yl)amino]-3-[4-(4-methoxyphenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0319 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)amino]-3-[4-(4-methoxyphenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 546.58 |
| Molecular Formula: | C32 H26 N4 O5 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 7.2758 |
| logD: | 7.2757 |
| logSw: | -6.0355 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.466 |
| InChI Key: | UODOBRSVAKHAEM-UHFFFAOYSA-N |