3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
					Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
			3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0312 | 
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(propan-2-yl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one | 
| Molecular Weight: | 496.57 | 
| Molecular Formula: | C29 H28 N4 O4 | 
| Smiles: | CC(C)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | 
| Stereo: | ACHIRAL | 
| logP: | 5.6211 | 
| logD: | 5.1735 | 
| logSw: | -5.7801 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 67.771 | 
| InChI Key: | JMDPSEJTIJDDLE-UHFFFAOYSA-N | 
 
				 
				