2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propylacetamide
Chemical Structure Depiction of
2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propylacetamide
2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propylacetamide
Compound characteristics
| Compound ID: | L880-0308 |
| Compound Name: | 2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propylacetamide |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C18 H22 N4 O3 S |
| Smiles: | CCCNC(CSC1=Nc2c3cc(ccc3n(C)c2C(N1C)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.752 |
| logD: | 1.752 |
| logSw: | -2.5078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.608 |
| InChI Key: | DEDLYLUKIGHRGU-UHFFFAOYSA-N |