2-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | F796-0357 |
| Compound Name: | 2-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C20 H21 Br N4 O2 |
| Smiles: | C1CCC(CCNC(CN2C=Nc3c4cc(ccc4[nH]c3C2=O)[Br])=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.5757 |
| logD: | 2.5757 |
| logSw: | -3.0317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.802 |
| InChI Key: | SPYREBMDFNSKRI-UHFFFAOYSA-N |