4-{[3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carbonyl]amino}benzoic acid
Chemical Structure Depiction of
4-{[3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carbonyl]amino}benzoic acid
4-{[3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carbonyl]amino}benzoic acid
Compound characteristics
| Compound ID: | 4514-0408 |
| Compound Name: | 4-{[3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carbonyl]amino}benzoic acid |
| Molecular Weight: | 349.41 |
| Molecular Formula: | C16 H19 N3 O4 S |
| Smiles: | CC/N=C1/N(CC)C(CC(C(Nc2ccc(cc2)C(O)=O)=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3184 |
| logD: | -0.0769 |
| logSw: | -2.882 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.959 |
| InChI Key: | QENDNHQQFYSJMC-LBPRGKRZSA-N |