benzyl 5-(3-chlorophenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 5-(3-chlorophenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 5-(3-chlorophenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V028-1741 |
| Compound Name: | benzyl 5-(3-chlorophenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 537.08 |
| Molecular Formula: | C28 H29 Cl N4 O3 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2cccc(c2)[Cl])N2C(CC(N3CCN(C)CC3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1948 |
| logD: | 3.9687 |
| logSw: | -4.5904 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.112 |
| InChI Key: | LPUNZXMSXQURPM-SANMLTNESA-N |