2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-methylacetamide
Chemical Structure Depiction of
2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-methylacetamide
2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-methylacetamide
Compound characteristics
| Compound ID: | G864-0001 |
| Compound Name: | 2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-methylacetamide |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C15 H16 N4 O2 S |
| Smiles: | CCN1C(=Nc2c3ccccc3[nH]c2C1=O)SCC(NC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1872 |
| logD: | 1.1872 |
| logSw: | -2.2749 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.619 |
| InChI Key: | QIYZLVQCDTVQOM-UHFFFAOYSA-N |