N-[2-(4-chlorophenyl)ethyl]-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
N-[2-(4-chlorophenyl)ethyl]-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Compound characteristics
| Compound ID: | K906-2503 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide |
| Molecular Weight: | 453.92 |
| Molecular Formula: | C24 H24 Cl N3 O4 |
| Smiles: | C(CNC(c1ccc(CNC2=C(C(C2=O)=O)N2CCOCC2)cc1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1213 |
| logD: | 2.1159 |
| logSw: | -3.257 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.022 |
| InChI Key: | RNOPRNHHFJBPQR-UHFFFAOYSA-N |