8-bromo-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-bromo-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-bromo-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F796-0406 |
| Compound Name: | 8-bromo-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 466.34 |
| Molecular Formula: | C22 H20 Br N5 O2 |
| Smiles: | C1CN(CCN1C(CN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4377 |
| logD: | 2.4377 |
| logSw: | -2.9445 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.95 |
| InChI Key: | YTWCJCKVCZOZAD-UHFFFAOYSA-N |