tert-butyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
tert-butyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
tert-butyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-1043 |
| Compound Name: | tert-butyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C27 H28 F N3 O3 S |
| Smiles: | CC1=C(C(c2ccccc2)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8874 |
| logD: | 4.8825 |
| logSw: | -4.7225 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.72 |
| InChI Key: | YOFNTMCDLVDPJT-XMMPIXPASA-N |