3-methyl-5-[(3-methylbutoxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-methyl-5-[(3-methylbutoxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
3-methyl-5-[(3-methylbutoxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4075-3289 |
| Compound Name: | 3-methyl-5-[(3-methylbutoxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1) |
| Molecular Weight: | 319.85 |
| Molecular Formula: | C13 H21 N3 O2 S |
| Salt: | HCl |
| Smiles: | CC(C)CCOCC1Cc2c(C)nn(C(N)=S)c2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0093 |
| logD: | 2.0093 |
| logSw: | -2.0077 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.991 |
| InChI Key: | MDJGOZXCBNPJPR-SNVBAGLBSA-N |