3-(butylamino)-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(butylamino)-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(butylamino)-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0346 |
| Compound Name: | 3-(butylamino)-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | CCCCNc1cc(c2C(c3ccccc3c3c2c1no3)=O)NCCO |
| Stereo: | ACHIRAL |
| logP: | 3.9665 |
| logD: | 3.9665 |
| logSw: | -4.319 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.136 |
| InChI Key: | VCMMKVBXRBTVAL-UHFFFAOYSA-N |