2-{[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)carbamothioyl]amino}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
2-{[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)carbamothioyl]amino}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
2-{[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)carbamothioyl]amino}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
Compound characteristics
Compound ID: | 8009-8843 |
Compound Name: | 2-{[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)carbamothioyl]amino}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide |
Molecular Weight: | 426.94 |
Molecular Formula: | C16 H19 Cl N6 O2 S2 |
Smiles: | CCN1CCc2c(C(N)=O)c(NC(NC(c3c(cnn3C)[Cl])=O)=S)sc2C1 |
Stereo: | ACHIRAL |
logP: | 0.8014 |
logD: | 0.1381 |
logSw: | -2.9266 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 84 |
InChI Key: | OTQKAHRUXNISID-UHFFFAOYSA-N |