tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V025-2686 |
| Compound Name: | tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 528.67 |
| Molecular Formula: | C27 H36 N4 O5 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2cccc(c2OC)OC)N2C(CC(N3CCN(C)CC3)=O)=CSC2=N1)C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2021 |
| logD: | 2.976 |
| logSw: | -3.3403 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.465 |
| InChI Key: | KITTWXXIYPAJHR-HSZRJFAPSA-N |