N-(4-bromo-3-methylphenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
N-(4-bromo-3-methylphenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | F796-0124 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide |
| Molecular Weight: | 425.28 |
| Molecular Formula: | C20 H17 Br N4 O2 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(CC(Nc3ccc(c(C)c3)[Br])=O)C=N1)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.7614 |
| logD: | 3.7614 |
| logSw: | -4.0194 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.446 |
| InChI Key: | JWVXMIPQTVQQPW-UHFFFAOYSA-N |