5-(butylamino)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(butylamino)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(butylamino)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0203 |
| Compound Name: | 5-(butylamino)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Smiles: | CCCCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)CCO |
| Stereo: | ACHIRAL |
| logP: | 4.4375 |
| logD: | 4.3621 |
| logSw: | -4.4761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.428 |
| InChI Key: | BTWVMANGFLKQPQ-UHFFFAOYSA-N |