3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(2-methyl-4-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(2-methyl-4-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(2-methyl-4-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | 3909-8590 |
| Compound Name: | 3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(2-methyl-4-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C21 H23 N5 O5 S |
| Smiles: | CCN(CC)C(CN1C=Nc2c(C1=O)c(C)c(C(Nc1ccc(cc1C)[N+]([O-])=O)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2069 |
| logD: | 1.6115 |
| logSw: | -2.919 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.692 |
| InChI Key: | DKTMVYTZUPAKMC-UHFFFAOYSA-N |