N-(2-{[(furan-2-yl)methyl](2-phenylethyl)amino}-2-oxoethyl)-3,5-dinitro-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
N-(2-{[(furan-2-yl)methyl](2-phenylethyl)amino}-2-oxoethyl)-3,5-dinitro-N-(prop-2-en-1-yl)benzamide
N-(2-{[(furan-2-yl)methyl](2-phenylethyl)amino}-2-oxoethyl)-3,5-dinitro-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V011-3349 |
| Compound Name: | N-(2-{[(furan-2-yl)methyl](2-phenylethyl)amino}-2-oxoethyl)-3,5-dinitro-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 492.49 |
| Molecular Formula: | C25 H24 N4 O7 |
| Smiles: | C=CCN(CC(N(CCc1ccccc1)Cc1ccco1)=O)C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6655 |
| logD: | 3.6655 |
| logSw: | -4.0041 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 106.602 |
| InChI Key: | WHTRBUWISGVGPH-UHFFFAOYSA-N |