3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | 3909-8582 |
| Compound Name: | 3-[2-(diethylamino)-2-oxoethyl]-5-methyl-N-(3-nitrophenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C20 H21 N5 O5 S |
| Smiles: | CCN(CC)C(CN1C=Nc2c(C1=O)c(C)c(C(Nc1cccc(c1)[N+]([O-])=O)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1006 |
| logD: | 1.8382 |
| logSw: | -3.0135 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.39 |
| InChI Key: | CFAVLFHEUAVPML-UHFFFAOYSA-N |