2-chloro-N-[3-(cyclohexylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(cyclohexylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(cyclohexylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3205 |
| Compound Name: | 2-chloro-N-[3-(cyclohexylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 457.91 |
| Molecular Formula: | C23 H24 Cl N3 O5 |
| Smiles: | COc1ccc(C(NC(=C\c2ccc(cc2)[N+]([O-])=O)\C(NC2CCCCC2)=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7623 |
| logD: | 3.1337 |
| logSw: | -5.0867 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.227 |
| InChI Key: | RSBWBUGULBDKLT-UHFFFAOYSA-N |