4-[({[5-(2,4-dichlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-[({[5-(2,4-dichlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
4-[({[5-(2,4-dichlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D665-0557 |
| Compound Name: | 4-[({[5-(2,4-dichlorophenyl)furan-2-yl]methyl}amino)methyl]benzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 412.7 |
| Molecular Formula: | C19 H15 Cl2 N O3 |
| Salt: | HCl |
| Smiles: | [H]N(Cc1ccc(cc1)C(O)=O)Cc1ccc(c2ccc(cc2[Cl])[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0634 |
| logD: | 5.0634 |
| logSw: | -4.9433 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.982 |
| InChI Key: | OCKIVSHSXOVKCV-UHFFFAOYSA-N |