methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V003-6573 |
| Compound Name: | methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 604.73 |
| Molecular Formula: | C32 H36 N4 O6 S |
| Smiles: | CCC1=C(C(c2ccc(c(c2)OC)OCc2ccccc2)N2C(CC(N3CCN(CC3)C(C)=O)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5733 |
| logD: | 3.5718 |
| logSw: | -3.6775 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.699 |
| InChI Key: | TYTUXNKRFXJYNZ-SSEXGKCCSA-N |