2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-methylbutyl)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-(3-methylbutyl)acetamide
2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | F394-0371 |
| Compound Name: | 2-{3-[(2-chlorophenyl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 454.93 |
| Molecular Formula: | C24 H24 Cl F N4 O2 |
| Smiles: | CC(C)CCNC(Cn1c2C(N(Cc3ccccc3[Cl])C=Nc2c2cc(ccc12)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4011 |
| logD: | 4.4011 |
| logSw: | -4.3665 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.513 |
| InChI Key: | DDOLGUHLLOQPIX-UHFFFAOYSA-N |