N-[(2-methoxyphenyl)methyl]-2-({6-oxo-5-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-2-({6-oxo-5-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
N-[(2-methoxyphenyl)methyl]-2-({6-oxo-5-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G604-0171 |
| Compound Name: | N-[(2-methoxyphenyl)methyl]-2-({6-oxo-5-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 513.51 |
| Molecular Formula: | C21 H18 F3 N3 O5 S2 |
| Smiles: | COc1ccccc1CNC(CSC1NC(C(=CN=1)S(c1cccc(c1)C(F)(F)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6084 |
| logD: | 0.9667 |
| logSw: | -3.2706 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.093 |
| InChI Key: | VRMXFZIQMKJTQB-UHFFFAOYSA-N |