5-(butylamino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(butylamino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(butylamino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0212 |
| Compound Name: | 5-(butylamino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C27 H27 N5 O2 |
| Smiles: | CCCCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 6.3806 |
| logD: | 6.375 |
| logSw: | -5.7559 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.754 |
| InChI Key: | XXBHMPDIKBAILQ-UHFFFAOYSA-N |