4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Compound characteristics
Compound ID: | 8015-1094 |
Compound Name: | 4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine |
Molecular Weight: | 398.49 |
Molecular Formula: | C18 H22 N8 O S |
Smiles: | C=CCn1c(c2ccco2)nnc1SCc1nc(N)nc(n1)N1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 3.1673 |
logD: | 3.1663 |
logSw: | -3.1036 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.5 |
InChI Key: | PMPRCKCVJHCVMA-UHFFFAOYSA-N |