1-[(4-chlorophenyl)methyl]-3-[(2-methylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-[(2-methylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-[(4-chlorophenyl)methyl]-3-[(2-methylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
Compound ID: | E745-0106 |
Compound Name: | 1-[(4-chlorophenyl)methyl]-3-[(2-methylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
Molecular Weight: | 438.93 |
Molecular Formula: | C23 H19 Cl N2 O3 S |
Smiles: | Cc1ccccc1N/C=C1/C(c2ccccc2N(Cc2ccc(cc2)[Cl])S1(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6946 |
logD: | 4.6946 |
logSw: | -4.8628 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.812 |
InChI Key: | HYSPFRWGUZDIHS-UHFFFAOYSA-N |