2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Compound characteristics
| Compound ID: | F475-0345 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate |
| Molecular Weight: | 485.94 |
| Molecular Formula: | C23 H20 Cl N3 O5 S |
| Smiles: | C(c1ccccc1[Cl])NC(COC(c1ccc(cc1)C1Nc2ccccc2S(N1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2915 |
| logD: | 3.2913 |
| logSw: | -3.5699 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.43 |
| InChI Key: | VHYYBVGBYWGDOJ-QFIPXVFZSA-N |