methyl 2-{[4-(4-methyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)piperazine-1-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[4-(4-methyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)piperazine-1-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{[4-(4-methyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)piperazine-1-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | F673-0251 |
| Compound Name: | methyl 2-{[4-(4-methyl-3-oxo-3,4-dihydropyrido[2,3-b]pyrazin-2-yl)piperazine-1-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C23 H26 N6 O4 S |
| Smiles: | CN1C(C(=Nc2cccnc12)N1CCN(CC1)C(Nc1c(C(=O)OC)c2CCCCc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2693 |
| logD: | 1.3882 |
| logSw: | -2.796 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.754 |
| InChI Key: | UHCYTWGMRCSDCC-UHFFFAOYSA-N |