5-[(2-hydroxyethyl)amino]-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-[(2-hydroxyethyl)amino]-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-[(2-hydroxyethyl)amino]-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0340 |
| Compound Name: | 5-[(2-hydroxyethyl)amino]-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 442.48 |
| Molecular Formula: | C24 H22 N6 O3 |
| Smiles: | C(CO)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.8526 |
| logD: | 3.8526 |
| logSw: | -4.3529 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.26 |
| InChI Key: | LQEPXNWKXHIDGA-UHFFFAOYSA-N |