1-butyl-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
1-butyl-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
1-butyl-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | 5701-2386 |
| Compound Name: | 1-butyl-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione |
| Molecular Weight: | 253.36 |
| Molecular Formula: | C12 H19 N3 O S |
| Smiles: | CCCCN1CN(Cc2ccco2)CNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.67 |
| logD: | 2.2821 |
| logSw: | -2.8004 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.3769 |
| InChI Key: | DUACMAFSSZFOTM-UHFFFAOYSA-N |