2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | F394-0336 |
| Compound Name: | 2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 464.88 |
| Molecular Formula: | C24 H18 Cl F N4 O3 |
| Smiles: | C(c1ccco1)NC(Cn1c2C(N(Cc3ccccc3[Cl])C=Nc2c2cc(ccc12)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2842 |
| logD: | 4.2842 |
| logSw: | -4.356 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.149 |
| InChI Key: | DOGJWOPQDHFYKU-UHFFFAOYSA-N |