2-(benzylsulfanyl)-3-(4-ethoxyphenyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-3-(4-ethoxyphenyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-(benzylsulfanyl)-3-(4-ethoxyphenyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G856-1114 |
| Compound Name: | 2-(benzylsulfanyl)-3-(4-ethoxyphenyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C25 H21 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)N1C(=Nc2c3ccccc3[nH]c2C1=O)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7414 |
| logD: | 4.7414 |
| logSw: | -4.6441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.241 |
| InChI Key: | ZANSHECGGGFCDS-UHFFFAOYSA-N |