3-methyl-5-[(pentyloxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-methyl-5-[(pentyloxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
3-methyl-5-[(pentyloxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4075-3206 |
| Compound Name: | 3-methyl-5-[(pentyloxy)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: | CCCCCOCC1Cc2c(C)nn(C(N)=S)c2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0669 |
| logD: | 2.0669 |
| logSw: | -2.0714 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.991 |
| InChI Key: | ULDGARMFNWIGOX-SNVBAGLBSA-N |