methyl 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(2,4-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(2,4-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(2,4-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V014-4466 |
| Compound Name: | methyl 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(2,4-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 544.72 |
| Molecular Formula: | C31 H36 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCC1=C(C(c2ccc(C)cc2C)N2C(CC(N3CCN(CC3)Cc3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.123 |
| logD: | 5.0935 |
| logSw: | -4.9925 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.099 |
| InChI Key: | BQFUKWILHPHDFJ-GDLZYMKVSA-N |