propan-2-yl 7-methyl-5-(4-nitrophenyl)-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
propan-2-yl 7-methyl-5-(4-nitrophenyl)-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
propan-2-yl 7-methyl-5-(4-nitrophenyl)-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-8904 |
| Compound Name: | propan-2-yl 7-methyl-5-(4-nitrophenyl)-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 507.57 |
| Molecular Formula: | C25 H25 N5 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)OC(C1C(c2ccc(cc2)[N+]([O-])=O)N2C(CC(NCc3ccncc3)=O)=CSC2=NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0511 |
| logD: | 3.0478 |
| logSw: | -3.1588 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.099 |
| InChI Key: | KDALJCSVHMCACQ-HSZRJFAPSA-N |