N-(4-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-(4-chlorophenyl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide
N-(4-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: | P580-0536 |
| Compound Name: | N-(4-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(Nc4ccc(cc4)[Cl])=O)c3C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.1122 |
| logD: | 3.1116 |
| logSw: | -3.5379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.687 |
| InChI Key: | RRYVINQTAOQXQY-UHFFFAOYSA-N |