4-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}phthalazin-1(2H)-one
Chemical Structure Depiction of
4-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}phthalazin-1(2H)-one
4-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | SA57-0221 |
| Compound Name: | 4-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}phthalazin-1(2H)-one |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C22 H23 N5 O4 |
| Smiles: | C1COC2(CCN(CC2)C(C2c3ccccc3C(NN=2)=O)=O)CC1Oc1ncccn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7829 |
| logD: | 0.3947 |
| logSw: | -2.085 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.378 |
| InChI Key: | XUOSIVHQOMUQFD-OAHLLOKOSA-N |