3-(4-chlorophenyl)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0010 |
| Compound Name: | 3-(4-chlorophenyl)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 315.8 |
| Molecular Formula: | C18 H18 Cl N O2 |
| Smiles: | C1CCC(CCNC2=C(C(C2=O)=O)c2ccc(cc2)[Cl])=CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8169 |
| logD: | 3.8169 |
| logSw: | -4.3869 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.25 |
| InChI Key: | NZKCKNDPDLTLIC-UHFFFAOYSA-N |