methyl 2-[(4-benzyl-3,4-dihydropyrido[2,3-b]pyrazine-1(2H)-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(4-benzyl-3,4-dihydropyrido[2,3-b]pyrazine-1(2H)-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-[(4-benzyl-3,4-dihydropyrido[2,3-b]pyrazine-1(2H)-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | F763-0091 |
| Compound Name: | methyl 2-[(4-benzyl-3,4-dihydropyrido[2,3-b]pyrazine-1(2H)-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Smiles: | [H]c1cc2c(nc1)N(CCN2C(Nc1c(C(=O)OC)c2CCCCc2s1)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9704 |
| logD: | 4.7178 |
| logSw: | -4.6285 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.234 |
| InChI Key: | STIJIKCDROMVTL-UHFFFAOYSA-N |