4-[(4-chlorophenyl)methyl]-2-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(4-chlorophenyl)methyl]-2-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
4-[(4-chlorophenyl)methyl]-2-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-6810 |
| Compound Name: | 4-[(4-chlorophenyl)methyl]-2-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 578.11 |
| Molecular Formula: | C35 H32 Cl N3 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc(/C=C2/C(N(Cc3ccc(cc3)[Cl])c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3146 |
| logD: | 7.3146 |
| logSw: | -6.3011 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.64 |
| InChI Key: | YWBRGQPVTHEAOJ-UHFFFAOYSA-N |