3-(2-hydroxyethyl)-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(2-hydroxyethyl)-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-(2-hydroxyethyl)-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8018-6811 |
| Compound Name: | 3-(2-hydroxyethyl)-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 426.45 |
| Molecular Formula: | C20 H18 N4 O5 S |
| Smiles: | Cc1cc(COC)c2c3c(C(N(CCO)C(c4ccc(cc4)[N+]([O-])=O)=N3)=O)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5668 |
| logD: | 2.5668 |
| logSw: | -2.8364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.336 |
| InChI Key: | QPLCCTAWGZRQKE-UHFFFAOYSA-N |