2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3-methylbutyl)acetamide
2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | M179-4007 |
| Compound Name: | 2-[(6-{[(4-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 378.92 |
| Molecular Formula: | C18 H23 Cl N4 O S |
| Smiles: | CC(C)CCNC(CSc1cc(NCc2ccc(cc2)[Cl])ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7902 |
| logD: | 3.7899 |
| logSw: | -4.1757 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.524 |
| InChI Key: | IEHNDKFDXKJBLK-UHFFFAOYSA-N |