5-[(4-chlorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-phenylethyl)benzamide
Chemical Structure Depiction of
5-[(4-chlorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-phenylethyl)benzamide
5-[(4-chlorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-phenylethyl)benzamide
Compound characteristics
| Compound ID: | V007-1912 |
| Compound Name: | 5-[(4-chlorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-phenylethyl)benzamide |
| Molecular Weight: | 525.05 |
| Molecular Formula: | C31 H29 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | C(CNC(c1cc(ccc1N1CCc2ccccc2C1)NC(Nc1ccc(cc1)[Cl])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9681 |
| logD: | 6.9681 |
| logSw: | -6.4595 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.61 |
| InChI Key: | YMSVLLGHRIQKFE-UHFFFAOYSA-N |