N-(3-acetylphenyl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]acetamide
N-(3-acetylphenyl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | M179-3330 |
| Compound Name: | N-(3-acetylphenyl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C21 H19 Cl N4 O2 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1cc(NCc2ccc(cc2)[Cl])ncn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9821 |
| logD: | 3.9818 |
| logSw: | -4.2514 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.915 |
| InChI Key: | VPQXDUAFSOZISZ-UHFFFAOYSA-N |