2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-phenylacetamide
Chemical Structure Depiction of
2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-phenylacetamide
2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-phenylacetamide
Compound characteristics
| Compound ID: | G856-1344 |
| Compound Name: | 2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-phenylacetamide |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | CCN1C(=Nc2c3ccccc3[nH]c2C1=O)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0947 |
| logD: | 3.0947 |
| logSw: | -3.3592 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.875 |
| InChI Key: | CBJBMHGORSXAFI-UHFFFAOYSA-N |