ethyl 2-amino-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-amino-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methylthiophene-3-carboxylate
ethyl 2-amino-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | R052-1614 |
| Compound Name: | ethyl 2-amino-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 344.43 |
| Molecular Formula: | C18 H20 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(C(N2CCc3ccccc3C2)=O)sc1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9721 |
| logD: | 2.9721 |
| logSw: | -3.0713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.579 |
| InChI Key: | QYZMSDHEUVXEPL-UHFFFAOYSA-N |