2,4-bis(propylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Chemical Structure Depiction of
2,4-bis(propylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
2,4-bis(propylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Compound characteristics
| Compound ID: | 6085-0114 |
| Compound Name: | 2,4-bis(propylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole |
| Molecular Weight: | 321.5 |
| Molecular Formula: | C16 H23 N3 S2 |
| Smiles: | CCCSc1c2c3CCCCc3[nH]c2nc(n1)SCCC |
| Stereo: | ACHIRAL |
| logP: | 4.8546 |
| logD: | 4.8545 |
| logSw: | -4.7989 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.7598 |
| InChI Key: | IJUPUMYULNNXMX-UHFFFAOYSA-N |