3-[(4-methoxyphenyl)methyl]-8-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-8-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[(4-methoxyphenyl)methyl]-8-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F394-0502 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-8-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | CC1CCCN(C1)C(Cn1c2C(N(Cc3ccc(cc3)OC)C=Nc2c2cc(C)ccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8255 |
| logD: | 3.8255 |
| logSw: | -3.9901 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.798 |
| InChI Key: | RRIPEGFJAHKQQJ-IBGZPJMESA-N |