1-[(4-chlorophenyl)methyl]-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-[(4-chlorophenyl)methyl]-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E745-0148 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 456.92 |
| Molecular Formula: | C23 H18 Cl F N2 O3 S |
| Smiles: | C(c1ccc(cc1)F)N\C=C1/C(c2ccccc2N(Cc2ccc(cc2)[Cl])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7134 |
| logD: | 3.7134 |
| logSw: | -4.4497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.041 |
| InChI Key: | QGOOFFIOYHEUMJ-UHFFFAOYSA-N |