2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-fluorophenyl)methyl]acetamide
2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F394-0241 |
| Compound Name: | 2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C26 H20 F2 N4 O2 |
| Smiles: | C(c1ccc(cc1)F)NC(Cn1c2C(N(Cc3ccccc3)C=Nc2c2cc(ccc12)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7441 |
| logD: | 3.7441 |
| logSw: | -4.1708 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.4 |
| InChI Key: | JODGAMYJMPTWOW-UHFFFAOYSA-N |