3-({4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}methyl)benzonitrile
					Chemical Structure Depiction of
3-({4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}methyl)benzonitrile
			3-({4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | J079-0832 | 
| Compound Name: | 3-({4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}methyl)benzonitrile | 
| Molecular Weight: | 387.48 | 
| Molecular Formula: | C24 H25 N3 O2 | 
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(CC1)Cc1cccc(C#N)c1)=CC(=O)O2 | 
| Stereo: | ACHIRAL | 
| logP: | 3.0456 | 
| logD: | 2.9596 | 
| logSw: | -3.4051 | 
| Hydrogen bond acceptors count: | 6 | 
| Polar surface area: | 44.975 | 
| InChI Key: | UVKMGZGGQRPFRQ-UHFFFAOYSA-N | 
 
				 
				