N~2~-[(adamantan-1-yl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
Chemical Structure Depiction of
N~2~-[(adamantan-1-yl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
N~2~-[(adamantan-1-yl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
Compound characteristics
Compound ID: | V001-1307 |
Compound Name: | N~2~-[(adamantan-1-yl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide |
Molecular Weight: | 565.78 |
Molecular Formula: | C32 H43 N3 O4 S |
Smiles: | Cc1ccc(CN(CCc2ccc(c(c2)OC)OC)C(CN(CC=C)C(NC23CC4CC(CC(C4)C3)C2)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 5.6744 |
logD: | 5.6744 |
logSw: | -5.4906 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.208 |
InChI Key: | ISKVZNLUQQDZPR-UHFFFAOYSA-N |