2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2,5-dimethylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2,5-dimethylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2,5-dimethylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0070 |
| Compound Name: | 2-({4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2,5-dimethylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 594.18 |
| Molecular Formula: | C35 H32 Cl N3 O2 S |
| Smiles: | Cc1ccc(C)c(CN2C(/C(=C/c3ccc(cc3)C(N3CCN(CC3)c3ccc(cc3)[Cl])=O)Sc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.9545 |
| logD: | 7.9545 |
| logSw: | -6.2784 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.978 |
| InChI Key: | YUXODTXEOKDQOK-UHFFFAOYSA-N |