tert-butyl 5-(3,4-dimethoxyphenyl)-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
tert-butyl 5-(3,4-dimethoxyphenyl)-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
tert-butyl 5-(3,4-dimethoxyphenyl)-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-0386 |
| Compound Name: | tert-butyl 5-(3,4-dimethoxyphenyl)-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 553.65 |
| Molecular Formula: | C29 H32 F N3 O5 S |
| Smiles: | CC1=C(C(c2ccc(c(c2)OC)OC)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5457 |
| logD: | 4.5408 |
| logSw: | -4.5842 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.98 |
| InChI Key: | DCMUXRDZDMSUEU-AREMUKBSSA-N |