methyl 2-[(2-chlorophenyl)carbamoyl]-8-methyl-4-oxo-6-(thiophen-2-yl)-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Chemical Structure Depiction of
methyl 2-[(2-chlorophenyl)carbamoyl]-8-methyl-4-oxo-6-(thiophen-2-yl)-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
methyl 2-[(2-chlorophenyl)carbamoyl]-8-methyl-4-oxo-6-(thiophen-2-yl)-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Compound characteristics
| Compound ID: | 8015-9178 |
| Compound Name: | methyl 2-[(2-chlorophenyl)carbamoyl]-8-methyl-4-oxo-6-(thiophen-2-yl)-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate |
| Molecular Weight: | 554.87 |
| Molecular Formula: | C21 H16 Cl N3 O4 S2 |
| Salt: | HBr |
| Smiles: | CC1=C(C(c2cccs2)N2C(=N1)SC(=CC2=O)C(Nc1ccccc1[Cl])=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1993 |
| logD: | 3.1726 |
| logSw: | -3.5488 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.763 |
| InChI Key: | RYAOKPGBQKFOGX-GOSISDBHSA-N |