N-[1-(adamantan-1-yl)ethyl]-2-(7-oxothieno[2,3-d]pyridazin-6(7H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-(7-oxothieno[2,3-d]pyridazin-6(7H)-yl)acetamide
N-[1-(adamantan-1-yl)ethyl]-2-(7-oxothieno[2,3-d]pyridazin-6(7H)-yl)acetamide
Compound characteristics
| Compound ID: | C700-1068 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-(7-oxothieno[2,3-d]pyridazin-6(7H)-yl)acetamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C20 H25 N3 O2 S |
| Smiles: | [H][C@]12CC3(C[C@]([H])(C1)C[C@@]([H])(C3)C2)C(C)NC(CN1C(c2c(C=N1)ccs2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1097 |
| logD: | 3.1097 |
| logSw: | -3.341 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.916 |
| InChI Key: | KCCBZODGMUCWEH-PGBBXINNSA-N |