2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | L880-0007 |
| Compound Name: | 2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C24 H26 N4 O3 S |
| Smiles: | CCc1ccc(cc1)NC(CSC1=Nc2c3cc(ccc3n(C)c2C(N1CC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4518 |
| logD: | 4.4518 |
| logSw: | -4.3404 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.132 |
| InChI Key: | FGGDEEOZQPCVQR-UHFFFAOYSA-N |