benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-0685 |
| Compound Name: | benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 557.64 |
| Molecular Formula: | C31 H28 F N3 O4 S |
| Smiles: | CC1=C(C(c2ccc(cc2)OC)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1218 |
| logD: | 5.1217 |
| logSw: | -5.1981 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.258 |
| InChI Key: | QMKXLGHWBXXAGU-GDLZYMKVSA-N |