{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}(1,3-thiazol-4-yl)methanone
Chemical Structure Depiction of
{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}(1,3-thiazol-4-yl)methanone
{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}(1,3-thiazol-4-yl)methanone
Compound characteristics
| Compound ID: | SC19-0349 |
| Compound Name: | {4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}(1,3-thiazol-4-yl)methanone |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C18 H25 N5 O2 S |
| Smiles: | CCn1c2CCOCc2c(CN2CCCN(CC2)C(c2cscn2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.4629 |
| logD: | -3.4819 |
| logSw: | -1.296 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.665 |
| InChI Key: | JXQWSPXVJFTSGP-UHFFFAOYSA-N |