N-(2,3-dihydro-1,4-benzodioxin-6-yl)-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-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-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: | P580-0509 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,7-dimethyl-5-oxopyrrolo[3,2-d][1,3,4]thiadiazolo[3,2-a]pyrimidin-6(5H)-yl)acetamide |
| Molecular Weight: | 411.44 |
| Molecular Formula: | C19 H17 N5 O4 S |
| Smiles: | CC1=NN2C(=Nc3cc(C)n(CC(Nc4ccc5c(c4)OCCO5)=O)c3C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.4901 |
| logD: | 1.4896 |
| logSw: | -2.5946 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.51 |
| InChI Key: | AUVUENJRYNKUGU-UHFFFAOYSA-N |