methyl 5-(2,4-dimethylphenyl)-7-ethyl-3-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(2,4-dimethylphenyl)-7-ethyl-3-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(2,4-dimethylphenyl)-7-ethyl-3-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V014-4476 |
| Compound Name: | methyl 5-(2,4-dimethylphenyl)-7-ethyl-3-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 548.66 |
| Molecular Formula: | C29 H32 N4 O5 S |
| Smiles: | CCC1=C(C(c2ccc(C)cc2C)N2C(CC(N3CCN(CC3)C(c3ccco3)=O)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0149 |
| logD: | 4.0081 |
| logSw: | -4.0094 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.593 |
| InChI Key: | MITLNIIJUXTIFG-AREMUKBSSA-N |