5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3-(2-phenylpropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3-(2-phenylpropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3-(2-phenylpropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0466 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3-(2-phenylpropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 463.91 |
| Molecular Formula: | C26 H20 Cl F2 N3 O |
| Smiles: | CC(CN1C=Nc2c3cc(ccc3n(Cc3c(cccc3[Cl])F)c2C1=O)F)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3551 |
| logD: | 6.3551 |
| logSw: | -6.2719 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | BTVUFWJFBCPQRB-INIZCTEOSA-N |