2-methylpropyl 2-{[5-chloro-2-(ethanesulfonyl)pyrimidine-4-carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
2-methylpropyl 2-{[5-chloro-2-(ethanesulfonyl)pyrimidine-4-carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
2-methylpropyl 2-{[5-chloro-2-(ethanesulfonyl)pyrimidine-4-carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D053-0350 |
| Compound Name: | 2-methylpropyl 2-{[5-chloro-2-(ethanesulfonyl)pyrimidine-4-carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C16 H19 Cl N4 O5 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)[Cl])=O)c1nc(C)c(C(=O)OCC(C)C)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2933 |
| logD: | 0.3768 |
| logSw: | -3.514 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.531 |
| InChI Key: | IIGQZIVCTIGHDT-UHFFFAOYSA-N |