N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | F424-1169 |
Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
Molecular Weight: | 461.95 |
Molecular Formula: | C19 H16 Cl N5 O3 S2 |
Smiles: | Cc1cc(c(cc1[Cl])OC)NC(CSC1=NNC(c2cc(c3cccs3)nn12)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1017 |
logD: | 4.1 |
logSw: | -4.4336 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.415 |
InChI Key: | SEYDTQWOYBWCHB-UHFFFAOYSA-N |