2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D425-0464 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 479.98 |
| Molecular Formula: | C25 H22 Cl N3 O3 S |
| Smiles: | C(c1ccccc1[Cl])NC(COC(CSc1nc2ccccc2n1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4326 |
| logD: | 5.4061 |
| logSw: | -5.9234 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.483 |
| InChI Key: | DDTLHRKYCFDYNN-UHFFFAOYSA-N |