butyl 4-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
butyl 4-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
butyl 4-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D358-0962 |
| Compound Name: | butyl 4-{[3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C25 H23 N3 O4 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(C1=CN=C2N(C(=CS2)c2ccc(C)cc2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1449 |
| logD: | 3.2914 |
| logSw: | -4.9308 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.383 |
| InChI Key: | LJJRQPURBVAOFS-UHFFFAOYSA-N |