3-(2-methoxyethyl)-2-(propylsulfanyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-(2-methoxyethyl)-2-(propylsulfanyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-(2-methoxyethyl)-2-(propylsulfanyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G864-0098 |
| Compound Name: | 3-(2-methoxyethyl)-2-(propylsulfanyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 317.41 |
| Molecular Formula: | C16 H19 N3 O2 S |
| Smiles: | CCCSC1=Nc2c3ccccc3[nH]c2C(N1CCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.766 |
| logD: | 2.766 |
| logSw: | -3.0123 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.593 |
| InChI Key: | PJEDUGASFCPAFX-UHFFFAOYSA-N |