2-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
2-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-3035 |
| Compound Name: | 2-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C26 H22 N4 O4 S |
| Smiles: | C1CN(CCN1C(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1423 |
| logD: | 4.1423 |
| logSw: | -4.2925 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.135 |
| InChI Key: | SSMXXJKIGKUZLM-UHFFFAOYSA-N |