N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N~2~-(thiophene-2-sulfonyl)valinamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N~2~-(thiophene-2-sulfonyl)valinamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N~2~-(thiophene-2-sulfonyl)valinamide
Compound characteristics
| Compound ID: | G557-0262 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N~2~-(thiophene-2-sulfonyl)valinamide |
| Molecular Weight: | 435.61 |
| Molecular Formula: | C21 H29 N3 O3 S2 |
| Smiles: | CC(C)C(C(NCCCN1CCc2ccccc2C1)=O)NS(c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8754 |
| logD: | 1.6713 |
| logSw: | -3.3379 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.751 |
| InChI Key: | GNLQADVFUSAYGP-FQEVSTJZSA-N |