5-[(4-tert-butylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(4-tert-butylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(4-tert-butylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | C200-8930 |
| Compound Name: | 5-[(4-tert-butylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 457.52 |
| Molecular Formula: | C28 H25 F2 N3 O |
| Smiles: | CC(C)(C)c1ccc(Cn2c3C(N(Cc4ccc(cc4)F)C=Nc3c3cc(ccc23)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3737 |
| logD: | 6.3737 |
| logSw: | -5.6209 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | HUAKTSFCASMGMO-UHFFFAOYSA-N |