N-(2-chlorophenyl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide
N-(2-chlorophenyl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide
Compound characteristics
Compound ID: | P580-0534 |
Compound Name: | N-(2-chlorophenyl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide |
Molecular Weight: | 387.85 |
Molecular Formula: | C17 H14 Cl N5 O2 S |
Smiles: | CC1=NN2C(=Nc3cc(C)n(CC(Nc4ccccc4[Cl])=O)c3C2=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.5683 |
logD: | 2.5676 |
logSw: | -3.158 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.989 |
InChI Key: | ZEQQBJVAJMLZPV-UHFFFAOYSA-N |