3-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0499 |
| Compound Name: | 3-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C27 H30 N4 O4 |
| Smiles: | COc1cc2c3c(C(N(CCC(N4CCC(CC4)Cc4ccccc4)=O)C=N3)=O)[nH]c2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8927 |
| logD: | 2.8927 |
| logSw: | -3.4369 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.657 |
| InChI Key: | KPOXXYGAYUWKJV-UHFFFAOYSA-N |