4-{3,4,4-trichloro-1-[(4-chlorophenyl)sulfanyl]-2-nitrobuta-1,3-dien-1-yl}morpholine
Chemical Structure Depiction of
4-{3,4,4-trichloro-1-[(4-chlorophenyl)sulfanyl]-2-nitrobuta-1,3-dien-1-yl}morpholine
4-{3,4,4-trichloro-1-[(4-chlorophenyl)sulfanyl]-2-nitrobuta-1,3-dien-1-yl}morpholine
Compound characteristics
| Compound ID: | 4872-0737 |
| Compound Name: | 4-{3,4,4-trichloro-1-[(4-chlorophenyl)sulfanyl]-2-nitrobuta-1,3-dien-1-yl}morpholine |
| Molecular Weight: | 430.13 |
| Molecular Formula: | C14 H12 Cl4 N2 O3 S |
| Smiles: | C1COCCN1/C(=C(/C(=C([Cl])[Cl])[Cl])[N+]([O-])=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6523 |
| logD: | 5.6523 |
| logSw: | -6.125 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.208 |
| InChI Key: | YEGXMJRUVWOXDL-UHFFFAOYSA-N |