N-(3-acetylphenyl)-2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
N-(3-acetylphenyl)-2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
Compound characteristics
| Compound ID: | F394-0244 |
| Compound Name: | N-(3-acetylphenyl)-2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide |
| Molecular Weight: | 468.49 |
| Molecular Formula: | C27 H21 F N4 O3 |
| Smiles: | CC(c1cccc(c1)NC(Cn1c2C(N(Cc3ccccc3)C=Nc2c2cc(ccc12)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8782 |
| logD: | 3.878 |
| logSw: | -4.0623 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.904 |
| InChI Key: | RJDBQIIFVFCYGG-UHFFFAOYSA-N |