5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-2503 |
| Compound Name: | 5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 457.46 |
| Molecular Formula: | C20 H19 N5 O6 S |
| Smiles: | Cc1c2C(N(CC(N3CCOCC3)=O)C=Nc2sc1C(Nc1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0614 |
| logD: | 0.799 |
| logSw: | -2.6864 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.015 |
| InChI Key: | IXQVOXFALCWFCO-UHFFFAOYSA-N |