5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4075-3161 |
| Compound Name: | 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide--hydrogen chloride (1/1) |
| Molecular Weight: | 305.82 |
| Molecular Formula: | C12 H19 N3 O2 S |
| Salt: | HCl |
| Smiles: | CCCCOCC1Cc2c(C)nn(C(N)=S)c2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5167 |
| logD: | 1.5167 |
| logSw: | -1.6664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.991 |
| InChI Key: | ZSPGOGOISCCQCX-SECBINFHSA-N |