methyl 2-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
methyl 2-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Compound characteristics
| Compound ID: | 8009-1602 |
| Compound Name: | methyl 2-{2-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C16 H14 N4 O4 S2 |
| Smiles: | CC1=CC(NC(=N1)SCC(Nc1nc2ccc(cc2s1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2589 |
| logD: | 1.5369 |
| logSw: | -2.8809 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.384 |
| InChI Key: | GPZCOGWLIGFNDC-UHFFFAOYSA-N |