methyl N-[(furan-2-yl)methyl]-N'-(3-phenyl-1H-pyrazol-5-yl)carbamimidothioate
Chemical Structure Depiction of
methyl N-[(furan-2-yl)methyl]-N'-(3-phenyl-1H-pyrazol-5-yl)carbamimidothioate
methyl N-[(furan-2-yl)methyl]-N'-(3-phenyl-1H-pyrazol-5-yl)carbamimidothioate
Compound characteristics
| Compound ID: | D019-1006 |
| Compound Name: | methyl N-[(furan-2-yl)methyl]-N'-(3-phenyl-1H-pyrazol-5-yl)carbamimidothioate |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C16 H16 N4 O S |
| Smiles: | CSC(\NCc1ccco1)=N/c1cc(c2ccccc2)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.8128 |
| logD: | 1.3928 |
| logSw: | -3.9787 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.654 |
| InChI Key: | LAVQJXNERBTQSH-UHFFFAOYSA-N |