methyl 5-(4-chlorophenyl)-7-ethyl-3-{2-[(2-methylpropyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-7-ethyl-3-{2-[(2-methylpropyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(4-chlorophenyl)-7-ethyl-3-{2-[(2-methylpropyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-0626 |
| Compound Name: | methyl 5-(4-chlorophenyl)-7-ethyl-3-{2-[(2-methylpropyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C22 H26 Cl N3 O3 S |
| Smiles: | CCC1=C(C(c2ccc(cc2)[Cl])N2C(CC(NCC(C)C)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1491 |
| logD: | 4.1476 |
| logSw: | -4.7258 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.909 |
| InChI Key: | WLKGKPDMXURWHJ-FQEVSTJZSA-N |