ethyl 4-{[3-benzyl-2-(benzylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3-benzyl-2-(benzylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate
ethyl 4-{[3-benzyl-2-(benzylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 8015-5557 |
| Compound Name: | ethyl 4-{[3-benzyl-2-(benzylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C28 H25 N3 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(C1=CC(N(Cc2ccccc2)/C(=N/Cc2ccccc2)S1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8798 |
| logD: | 5.8773 |
| logSw: | -5.5531 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.411 |
| InChI Key: | LFIBMFPYXMJVHV-UHFFFAOYSA-N |