N-[(2RS)-butan-2-yl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-[(2RS)-butan-2-yl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
N-[(2RS)-butan-2-yl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | F796-0617 |
| Compound Name: | N-[(2RS)-butan-2-yl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide |
| Molecular Weight: | 358.4 |
| Molecular Formula: | C18 H22 N4 O4 |
| Smiles: | CC[C@H](C)NC(CN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7769 |
| logD: | 0.7769 |
| logSw: | -1.5606 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.742 |
| InChI Key: | XTRMVWBWEGBNGW-JTQLQIEISA-N |