1-benzyl-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-benzyl-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-benzyl-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E745-0096 |
| Compound Name: | 1-benzyl-3-({[(4-fluorophenyl)methyl]amino}methylidene)-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C23 H19 F N2 O3 S |
| Smiles: | C(c1ccc(cc1)F)N\C=C1/C(c2ccccc2N(Cc2ccccc2)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1187 |
| logD: | 3.1187 |
| logSw: | -3.8526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.041 |
| InChI Key: | RJOWXPVFOQTCMK-UHFFFAOYSA-N |