benzyl 7-methyl-5-(2-methylphenyl)-3-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 7-methyl-5-(2-methylphenyl)-3-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 7-methyl-5-(2-methylphenyl)-3-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-9464 |
| Compound Name: | benzyl 7-methyl-5-(2-methylphenyl)-3-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 517.65 |
| Molecular Formula: | C29 H31 N3 O4 S |
| Smiles: | CC1=C(C(c2ccccc2C)N2C(CC(NCC3CCCO3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9968 |
| logD: | 3.9961 |
| logSw: | -4.2608 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.368 |
| InChI Key: | MFPGXFXPHPVULE-UHFFFAOYSA-N |