methyl 4-{[3-methyl-2-(methylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate--hydrogen bromide (1/1)
Chemical Structure Depiction of
methyl 4-{[3-methyl-2-(methylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate--hydrogen bromide (1/1)
methyl 4-{[3-methyl-2-(methylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8016-0267 |
| Compound Name: | methyl 4-{[3-methyl-2-(methylimino)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carbonyl]amino}benzoate--hydrogen bromide (1/1) |
| Molecular Weight: | 414.28 |
| Molecular Formula: | C15 H15 N3 O4 S |
| Salt: | HBr |
| Smiles: | C/N=C1\N(C)C(C=C(C(Nc2ccc(cc2)C(=O)OC)=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7713 |
| logD: | 1.751 |
| logSw: | -2.4297 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.375 |
| InChI Key: | WXONFWOZMWJJEU-FOCLMDBBSA-N |