N-(3-bromophenyl)-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
N-(3-bromophenyl)-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | D358-0890 |
Compound Name: | N-(3-bromophenyl)-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 440.32 |
Molecular Formula: | C20 H14 Br N3 O2 S |
Smiles: | Cc1ccc(cc1)C1=CSC2=NC=C(C(Nc3cccc(c3)[Br])=O)C(N12)=O |
Stereo: | ACHIRAL |
logP: | 4.3669 |
logD: | 2.3258 |
logSw: | -4.308 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.336 |
InChI Key: | VLCHMIXEAJBQDX-UHFFFAOYSA-N |