3-benzyl-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
3-benzyl-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
3-benzyl-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | D149-0165 |
| Compound Name: | 3-benzyl-9-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 474.54 |
| Molecular Formula: | C25 H22 N4 O4 S |
| Smiles: | Cc1cc(COC)c2c3c(C(N(Cc4ccccc4)C(c4ccc(cc4)[N+]([O-])=O)N3)=O)sc2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3041 |
| logD: | 4.2836 |
| logSw: | -4.5167 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.423 |
| InChI Key: | GGFIXYMROQMCCC-HSZRJFAPSA-N |