6-benzyl-2-[(4-bromophenyl)methylidene]-5-methyl-7H-[1,3]thiazolo[3,2-a]pyrimidine-3,7(2H)-dione
Chemical Structure Depiction of
6-benzyl-2-[(4-bromophenyl)methylidene]-5-methyl-7H-[1,3]thiazolo[3,2-a]pyrimidine-3,7(2H)-dione
6-benzyl-2-[(4-bromophenyl)methylidene]-5-methyl-7H-[1,3]thiazolo[3,2-a]pyrimidine-3,7(2H)-dione
Compound characteristics
Compound ID: | Y070-3276 |
Compound Name: | 6-benzyl-2-[(4-bromophenyl)methylidene]-5-methyl-7H-[1,3]thiazolo[3,2-a]pyrimidine-3,7(2H)-dione |
Molecular Weight: | 439.33 |
Molecular Formula: | C21 H15 Br N2 O2 S |
Smiles: | CC1=C(Cc2ccccc2)C(N=C2N1C(/C(=C/c1ccc(cc1)[Br])S2)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3815 |
logD: | 4.3815 |
logSw: | -4.4325 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 38.783 |
InChI Key: | BNWHWUFLSZPQQI-UHFFFAOYSA-N |