3-benzyl-5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-benzyl-5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-benzyl-5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0259 |
| Compound Name: | 3-benzyl-5-[(2-chloro-6-fluorophenyl)methyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 435.86 |
| Molecular Formula: | C24 H16 Cl F2 N3 O |
| Smiles: | C(c1ccccc1)N1C=Nc2c3cc(ccc3n(Cc3c(cccc3[Cl])F)c2C1=O)F |
| Stereo: | ACHIRAL |
| logP: | 5.1632 |
| logD: | 5.1632 |
| logSw: | -5.6676 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | VDFCSONIRVCEAD-UHFFFAOYSA-N |