3-(3,4-dimethoxyphenyl)-N-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
3-(3,4-dimethoxyphenyl)-N-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0644 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 508.53 |
| Molecular Formula: | C26 H28 N4 O7 |
| Smiles: | COc1ccc(cc1OC)N1C(c2ccccc2C(C(NCC(N2CCC3(CC2)OCCO3)=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9959 |
| logD: | 0.9958 |
| logSw: | -2.3638 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.551 |
| InChI Key: | NKAQVVCYXZGZLQ-UHFFFAOYSA-N |