5-oxo-3-phenyl-N-[2-(phenylsulfanyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-oxo-3-phenyl-N-[2-(phenylsulfanyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
5-oxo-3-phenyl-N-[2-(phenylsulfanyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | D358-0678 |
Compound Name: | 5-oxo-3-phenyl-N-[2-(phenylsulfanyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 455.56 |
Molecular Formula: | C25 H17 N3 O2 S2 |
Smiles: | C1=C(C(Nc2ccccc2Sc2ccccc2)=O)C(N2C(=CSC2=N1)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.7669 |
logD: | 4.7347 |
logSw: | -4.7797 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.366 |
InChI Key: | ZKDHMGBHXBCFSG-UHFFFAOYSA-N |