8-bromo-3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-bromo-3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-bromo-3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F796-0410 |
| Compound Name: | 8-bromo-3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 472.38 |
| Molecular Formula: | C22 H26 Br N5 O2 |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4596 |
| logD: | 2.2972 |
| logSw: | -2.8968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.783 |
| InChI Key: | HMUPXUNEUHBFEK-UHFFFAOYSA-N |