3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
Chemical Structure Depiction of
3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
Compound characteristics
Compound ID: | V031-0788 |
Compound Name: | 3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide |
Molecular Weight: | 496.67 |
Molecular Formula: | C31 H32 N2 O2 S |
Salt: | not_available |
Smiles: | COc1ccc(cc1)c1ccc(CCC(NC2CCCc3ccccc23)=O)n1c1ccc(cc1)SC |
Stereo: | RACEMIC MIXTURE |
logP: | 7.2734 |
logD: | 7.2734 |
logSw: | -5.8106 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.983 |
InChI Key: | UFBVLCUZKWQRPR-LJAQVGFWSA-N |