5-methyl-N-(2-methyl-4-nitrophenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-methyl-N-(2-methyl-4-nitrophenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
5-methyl-N-(2-methyl-4-nitrophenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-2592 |
| Compound Name: | 5-methyl-N-(2-methyl-4-nitrophenyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 471.49 |
| Molecular Formula: | C21 H21 N5 O6 S |
| Smiles: | Cc1cc(ccc1NC(c1c(C)c2C(N(CC(N3CCOCC3)=O)C=Nc2s1)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1676 |
| logD: | 0.5723 |
| logSw: | -2.6619 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.317 |
| InChI Key: | MWTIUEQJZDQCOI-UHFFFAOYSA-N |