N-butyl-N-(2-{[(furan-2-yl)methyl][(1-methyl-1H-pyrrol-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-butyl-N-(2-{[(furan-2-yl)methyl][(1-methyl-1H-pyrrol-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
N-butyl-N-(2-{[(furan-2-yl)methyl][(1-methyl-1H-pyrrol-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V007-9183 |
| Compound Name: | N-butyl-N-(2-{[(furan-2-yl)methyl][(1-methyl-1H-pyrrol-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C24 H28 N4 O5 |
| Smiles: | CCCCN(CC(N(Cc1cccn1C)Cc1ccco1)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6692 |
| logD: | 3.6692 |
| logSw: | -3.6216 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.14 |
| InChI Key: | FDOUOMDKZDQFGR-UHFFFAOYSA-N |