ethyl 4-[(4-benzyl-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(4-benzyl-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carbonyl)amino]benzoate
ethyl 4-[(4-benzyl-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | C531-0501 |
| Compound Name: | ethyl 4-[(4-benzyl-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carbonyl)amino]benzoate |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C25 H22 N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1ccc2c(c1)N(Cc1ccccc1)C(CS2=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8589 |
| logD: | 3.8583 |
| logSw: | -4.0185 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.621 |
| InChI Key: | QOVVFWLRJUKHGK-UHFFFAOYSA-N |