N-(2-bromophenyl)-2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(2-bromophenyl)-2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | C716-0521 |
Compound Name: | N-(2-bromophenyl)-2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 514.8 |
Molecular Formula: | C18 H13 Br Cl N3 O4 S2 |
Smiles: | C(C(Nc1ccccc1[Br])=O)SC1NC(C(=CN=1)S(c1cccc(c1)[Cl])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7399 |
logD: | 1.0981 |
logSw: | -3.5569 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.442 |
InChI Key: | RJLNLUAKQWDHDL-UHFFFAOYSA-N |