methyl 7-methyl-5-(4-nitrophenyl)-3-{2-oxo-2-[(propan-2-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-5-(4-nitrophenyl)-3-{2-oxo-2-[(propan-2-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-methyl-5-(4-nitrophenyl)-3-{2-oxo-2-[(propan-2-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V025-2216 |
| Compound Name: | methyl 7-methyl-5-(4-nitrophenyl)-3-{2-oxo-2-[(propan-2-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C20 H22 N4 O5 S |
| Smiles: | CC(C)NC(CC1=CSC2=NC(C)=C(C(c3ccc(cc3)[N+]([O-])=O)N12)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6769 |
| logD: | 2.6763 |
| logSw: | -2.9997 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.658 |
| InChI Key: | LJIGAWFOJVZKQO-SFHVURJKSA-N |