methyl 2-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
methyl 2-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D358-0918 |
| Compound Name: | methyl 2-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C22 H17 N3 O4 S |
| Smiles: | Cc1ccc(cc1)C1=CSC2=NC=C(C(Nc3ccccc3C(=O)OC)=O)C(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4816 |
| logD: | -0.5831 |
| logSw: | -3.766 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.812 |
| InChI Key: | UHRLRAJUUANSAG-UHFFFAOYSA-N |