1-cyclopentyl-N-[3-(methylsulfanyl)phenyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-cyclopentyl-N-[3-(methylsulfanyl)phenyl]-1H-benzotriazole-5-carboxamide
1-cyclopentyl-N-[3-(methylsulfanyl)phenyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
Compound ID: | F058-1306 |
Compound Name: | 1-cyclopentyl-N-[3-(methylsulfanyl)phenyl]-1H-benzotriazole-5-carboxamide |
Molecular Weight: | 352.46 |
Molecular Formula: | C19 H20 N4 O S |
Smiles: | CSc1cccc(c1)NC(c1ccc2c(c1)nnn2C1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.8656 |
logD: | 3.8654 |
logSw: | -4.0183 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.091 |
InChI Key: | MOIZEMSNRUYREH-UHFFFAOYSA-N |