3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | C200-4125 |
| Compound Name: | 3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C24 H21 Cl N2 O4 S |
| Smiles: | Cc1ccc(CN2c3ccccc3C(/C(=C\Nc3ccc(c(c3)[Cl])OC)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8256 |
| logD: | 4.823 |
| logSw: | -4.8647 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.14 |
| InChI Key: | RVBWUZXJOYTUIL-UHFFFAOYSA-N |