prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(2,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(2,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(2,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V021-5655 |
| Compound Name: | prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(2,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C27 H32 N4 O6 S |
| Smiles: | CC1=C(C(c2cc(ccc2OC)OC)N2C(CC(N3CCN(CC3)C(C)=O)=O)=CSC2=N1)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5271 |
| logD: | 2.5269 |
| logSw: | -2.9545 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.195 |
| InChI Key: | HXPSBNOADOIXCQ-RUZDIDTESA-N |