2-({4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-({4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-1-benzothiophen-3(2H)-one
2-({4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-1-benzothiophen-3(2H)-one
Compound characteristics
Compound ID: | 8007-0077 |
Compound Name: | 2-({4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-1-benzothiophen-3(2H)-one |
Molecular Weight: | 443.35 |
Molecular Formula: | C23 H16 Cl2 O3 S |
Smiles: | COc1cc(\C=C2/C(c3ccccc3S2)=O)ccc1OCc1ccc(cc1[Cl])[Cl] |
Stereo: | ACHIRAL |
logP: | 6.274 |
logD: | 6.274 |
logSw: | -6.0951 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 28.3445 |
InChI Key: | DOEFHXDBPMGCQF-UHFFFAOYSA-N |