1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E745-0050 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C25 H24 N2 O3 S |
| Smiles: | Cc1ccc(CN2c3ccccc3C(/C(=C\NCCc3ccccc3)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7112 |
| logD: | 3.7112 |
| logSw: | -4.0222 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.882 |
| InChI Key: | GMJFMYXWHNFDSI-UHFFFAOYSA-N |