ethyl 4-({[(furan-2-yl)methyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[(furan-2-yl)methyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({[(furan-2-yl)methyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
Compound ID: | K784-4473 |
Compound Name: | ethyl 4-({[(furan-2-yl)methyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate |
Molecular Weight: | 395.48 |
Molecular Formula: | C21 H21 N3 O3 S |
Smiles: | CCOC(c1ccc(cc1)NC(N(Cc1cccnc1)Cc1ccco1)=S)=O |
Stereo: | ACHIRAL |
logP: | 3.9219 |
logD: | 3.9213 |
logSw: | -3.6951 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.448 |
InChI Key: | OAJHDWVJZYUKHA-UHFFFAOYSA-N |