2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide
2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide
Compound characteristics
Compound ID: | M179-3192 |
Compound Name: | 2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide |
Molecular Weight: | 444.94 |
Molecular Formula: | C21 H21 Cl N4 O3 S |
Smiles: | COc1ccc(cc1OC)NC(CSc1cc(NCc2ccccc2[Cl])ncn1)=O |
Stereo: | ACHIRAL |
logP: | 3.9634 |
logD: | 3.9632 |
logSw: | -4.1739 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.35 |
InChI Key: | OWUSWLUCFFDTDZ-UHFFFAOYSA-N |