2-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Chemical Structure Depiction of
2-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
2-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Compound characteristics
| Compound ID: | E019-0902 |
| Compound Name: | 2-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | CC1c2c(C(N(CCCC(N3CCC4(CC3)OCCO4)=O)N=1)=O)c1ccccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 2.0147 |
| logD: | 2.0147 |
| logSw: | -2.343 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.194 |
| InChI Key: | DUSALJASWCTACV-UHFFFAOYSA-N |