methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-6787 |
| Compound Name: | methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 576.72 |
| Molecular Formula: | C31 H36 N4 O5 S |
| Salt: | not_available |
| Smiles: | CCC1=C(C(c2ccc(c(c2)OC)OCc2ccccc2)N2C(CC(N3CCN(C)CC3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7492 |
| logD: | 3.5231 |
| logSw: | -3.9752 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.979 |
| InChI Key: | WIKQJEFYBDIIHS-GDLZYMKVSA-N |