methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(2-phenoxyethyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(2-phenoxyethyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(2-phenoxyethyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V021-2314 |
| Compound Name: | methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(2-phenoxyethyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 498 |
| Molecular Formula: | C25 H24 Cl N3 O4 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])N2C(CC(NCCOc3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3957 |
| logD: | 4.3951 |
| logSw: | -4.8783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.29 |
| InChI Key: | RRSGYZSJQGOCQD-QHCPKHFHSA-N |