N-{4-methyl-2-[3-({2-[(naphthalen-1-yl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
Chemical Structure Depiction of
N-{4-methyl-2-[3-({2-[(naphthalen-1-yl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
N-{4-methyl-2-[3-({2-[(naphthalen-1-yl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
Compound characteristics
Compound ID: | F151-0200 |
Compound Name: | N-{4-methyl-2-[3-({2-[(naphthalen-1-yl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide |
Molecular Weight: | 473.55 |
Molecular Formula: | C25 H23 N5 O3 S |
Smiles: | CCC(Nc1ccc(C)cc1C1C(NC(=NN=1)SCC(Nc1cccc2ccccc12)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2818 |
logD: | 3.2476 |
logSw: | -3.5173 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 89.427 |
InChI Key: | GTCOKDSXJWGOMP-UHFFFAOYSA-N |