4-[({[5-(4-chlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-[({[5-(4-chlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
4-[({[5-(4-chlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | J032-0012 |
Compound Name: | 4-[({[5-(4-chlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1) |
Molecular Weight: | 378.25 |
Molecular Formula: | C19 H16 Cl N O3 |
Salt: | HCl |
Smiles: | [H]N(Cc1ccc(cc1)C(O)=O)Cc1ccc(c2ccc(cc2)[Cl])o1 |
Stereo: | ACHIRAL |
logP: | 4.5764 |
logD: | 4.5764 |
logSw: | -4.6038 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 47.982 |
InChI Key: | ASEQUUZPUHVCLM-UHFFFAOYSA-N |