N-butyl-N-[1,1-dichloro-3-(imidazolidin-2-ylidene)-3-nitroprop-1-en-2-yl]butan-1-amine
Chemical Structure Depiction of
N-butyl-N-[1,1-dichloro-3-(imidazolidin-2-ylidene)-3-nitroprop-1-en-2-yl]butan-1-amine
N-butyl-N-[1,1-dichloro-3-(imidazolidin-2-ylidene)-3-nitroprop-1-en-2-yl]butan-1-amine
Compound characteristics
| Compound ID: | 4872-0166 |
| Compound Name: | N-butyl-N-[1,1-dichloro-3-(imidazolidin-2-ylidene)-3-nitroprop-1-en-2-yl]butan-1-amine |
| Molecular Weight: | 351.27 |
| Molecular Formula: | C14 H24 Cl2 N4 O2 |
| Smiles: | CCCCN(CCCC)C(C(=C1NCCN1)[N+]([O-])=O)=C([Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9894 |
| logD: | 3.9864 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.055 |
| InChI Key: | YRBDEEXZZGZQOW-UHFFFAOYSA-N |