5-[2-(azepan-1-yl)-2-oxoethyl]-7-methyl-2-(propan-2-yl)[1,3]thiazolo[4,5-d]pyridazin-4(5H)-one
Chemical Structure Depiction of
5-[2-(azepan-1-yl)-2-oxoethyl]-7-methyl-2-(propan-2-yl)[1,3]thiazolo[4,5-d]pyridazin-4(5H)-one
5-[2-(azepan-1-yl)-2-oxoethyl]-7-methyl-2-(propan-2-yl)[1,3]thiazolo[4,5-d]pyridazin-4(5H)-one
Compound characteristics
| Compound ID: | P124-1059 |
| Compound Name: | 5-[2-(azepan-1-yl)-2-oxoethyl]-7-methyl-2-(propan-2-yl)[1,3]thiazolo[4,5-d]pyridazin-4(5H)-one |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C17 H24 N4 O2 S |
| Smiles: | CC(C)c1nc2C(N(CC(N3CCCCCC3)=O)N=C(C)c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7386 |
| logD: | 2.7386 |
| logSw: | -2.7998 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.23 |
| InChI Key: | PAWPTAKZBWMXND-UHFFFAOYSA-N |