N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-{N-[(4-fluorophenyl)methyl](prop-2-en-1-yl)carbamamido}phenyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-{N-[(4-fluorophenyl)methyl](prop-2-en-1-yl)carbamamido}phenyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-{N-[(4-fluorophenyl)methyl](prop-2-en-1-yl)carbamamido}phenyl)acetamide
Compound characteristics
| Compound ID: | V010-7414 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-{N-[(4-fluorophenyl)methyl](prop-2-en-1-yl)carbamamido}phenyl)acetamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C27 H26 F N3 O4 |
| Smiles: | C=CCNC(N(Cc1ccc(cc1)F)c1cccc(CC(NCc2ccc3c(c2)OCO3)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0967 |
| logD: | 4.0967 |
| logSw: | -4.433 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.161 |
| InChI Key: | HJQROERLJOCXMT-UHFFFAOYSA-N |