3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | C880-2174 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C25 H25 F N4 O2 |
| Smiles: | C1CCCN(CC1)C(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7465 |
| logD: | 3.7465 |
| logSw: | -3.9611 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.795 |
| InChI Key: | LTBYAUJZKYEFMW-UHFFFAOYSA-N |