2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0440 |
| Compound Name: | 2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 564.08 |
| Molecular Formula: | C34 H30 Cl N3 O3 |
| Smiles: | Cc1cccc(CN2C(/C(=C\c3ccc(cc3)C(N3CCN(CC3)c3ccc(cc3)[Cl])=O)Oc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.9248 |
| logD: | 6.9248 |
| logSw: | -6.303 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.941 |
| InChI Key: | LQMJTBPXXCUHDX-UHFFFAOYSA-N |