N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(2-phenylethyl)-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(2-phenylethyl)-1,3-benzoxazole-6-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(2-phenylethyl)-1,3-benzoxazole-6-carboxamide
Compound characteristics
| Compound ID: | G706-1595 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(2-phenylethyl)-1,3-benzoxazole-6-carboxamide |
| Molecular Weight: | 439.56 |
| Molecular Formula: | C28 H29 N3 O2 |
| Smiles: | C(CNC(c1ccc2c(c1)oc(CCc1ccccc1)n2)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 5.3229 |
| logD: | 4.1731 |
| logSw: | -5.6292 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.614 |
| InChI Key: | TXSDRFKNPJARAI-UHFFFAOYSA-N |