1-[(4-methylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-[(4-methylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | C200-3297 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-({[(thiophen-2-yl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C22 H20 N2 O3 S2 |
| Smiles: | Cc1ccc(CN2c3ccccc3C(/C(=C/NCc3cccs3)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4999 |
| logD: | 3.4998 |
| logSw: | -3.978 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.059 |
| InChI Key: | UHHUGMXFNQCIKH-UHFFFAOYSA-N |