3-(butylamino)-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(butylamino)-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(butylamino)-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0311 |
| Compound Name: | 3-(butylamino)-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | CCCCNc1cc(c2C(c3ccccc3c3c2c1no3)=O)NC(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.3474 |
| logD: | 5.3474 |
| logSw: | -5.4328 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.613 |
| InChI Key: | AAQBOGMHWSHRCZ-UHFFFAOYSA-N |