methyl 5-(4-chlorophenyl)-7-methyl-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V030-7426 |
| Compound Name: | methyl 5-(4-chlorophenyl)-7-methyl-3-{2-[(3-methylbutyl)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 |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(CC1=CSC2=NC(C)=C(C(c3ccc(cc3)[Cl])N12)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0584 |
| logD: | 4.0578 |
| logSw: | -4.724 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.143 |
| InChI Key: | CEFGRJLAYILLHB-FQEVSTJZSA-N |