4-methyl-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-methyl-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
4-methyl-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-6970 |
| Compound Name: | 4-methyl-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C27 H25 N3 O3 |
| Smiles: | CN1C(/C(=C\c2ccc(cc2)C(N2CCN(CC2)c2ccccc2)=O)Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6744 |
| logD: | 3.6744 |
| logSw: | -4.0003 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.979 |
| InChI Key: | GEXIQTYUPDDIRH-UHFFFAOYSA-N |