2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
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-(4-phenylbutan-2-yl)acetamide
2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | L880-0278 |
| Compound Name: | 2-[(8-methoxy-3,5-dimethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C25 H28 N4 O3 S |
| Smiles: | CC(CCc1ccccc1)NC(CSC1=Nc2c3cc(ccc3n(C)c2C(N1C)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6294 |
| logD: | 3.6294 |
| logSw: | -4.187 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.936 |
| InChI Key: | ZYWJXLCBULDMOH-INIZCTEOSA-N |