methyl 4-(2-{2,4-dioxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{2,4-dioxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
methyl 4-(2-{2,4-dioxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F795-0223 |
| Compound Name: | methyl 4-(2-{2,4-dioxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate |
| Molecular Weight: | 494.53 |
| Molecular Formula: | C24 H22 N4 O6 S |
| Smiles: | COC(c1ccc(cc1)NC(CN1C(N(CC2CCCO2)C(c2c1c1cccnc1s2)=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8505 |
| logD: | 2.8502 |
| logSw: | -3.213 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.554 |
| InChI Key: | HTOQKRDYSPULBL-MRXNPFEDSA-N |