4-({[(furan-2-yl)methyl]carbamothioyl}amino)-1-methyl-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
4-({[(furan-2-yl)methyl]carbamothioyl}amino)-1-methyl-1H-pyrazole-5-carboxylic acid
4-({[(furan-2-yl)methyl]carbamothioyl}amino)-1-methyl-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y503-3997 |
| Compound Name: | 4-({[(furan-2-yl)methyl]carbamothioyl}amino)-1-methyl-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 280.3 |
| Molecular Formula: | C11 H12 N4 O3 S |
| Smiles: | Cn1c(C(O)=O)c(cn1)NC(NCc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 0.3156 |
| logD: | -3.6362 |
| logSw: | -1.9638 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.358 |
| InChI Key: | BURJJDIMTCMFCF-UHFFFAOYSA-N |