5-[(2-methylpropyl)amino]-3-(pyrrolidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-[(2-methylpropyl)amino]-3-(pyrrolidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-[(2-methylpropyl)amino]-3-(pyrrolidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0214 |
| Compound Name: | 5-[(2-methylpropyl)amino]-3-(pyrrolidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Smiles: | CC(C)CNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.4081 |
| logD: | 5.4081 |
| logSw: | -5.5429 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.507 |
| InChI Key: | LXDPYIAGJBROPJ-UHFFFAOYSA-N |