methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V003-6561 |
| Compound Name: | methyl 5-[4-(benzyloxy)-3-methoxyphenyl]-7-ethyl-3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 601.7 |
| Molecular Formula: | C33 H32 F N3 O5 S |
| Smiles: | CCC1=C(C(c2ccc(c(c2)OC)OCc2ccccc2)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2968 |
| logD: | 5.2953 |
| logSw: | -5.3908 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.582 |
| InChI Key: | YFEBXDYEOZMKEN-WJOKGBTCSA-N |