benzyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V011-3903 |
| Compound Name: | benzyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 565.09 |
| Molecular Formula: | C29 H29 Cl N4 O4 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])N2C(CC(N3CCN(CC3)C(C)=O)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0107 |
| logD: | 4.0105 |
| logSw: | -4.7932 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.831 |
| InChI Key: | NGUBWYPXXMNBHL-MHZLTWQESA-N |