N-(4,5-dimethyl-1,3-thiazol-2-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
Compound ID: | Y044-1300 |
Compound Name: | N-(4,5-dimethyl-1,3-thiazol-2-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
Molecular Weight: | 413.54 |
Molecular Formula: | C22 H27 N3 O3 S |
Smiles: | Cc1c(C)sc(NC(C2c3ccccc3C(N(CCOC)C23CCCC3)=O)=O)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.5863 |
logD: | 2.764 |
logSw: | -3.7905 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.303 |
InChI Key: | GEWIKFSEQFZMOP-GOSISDBHSA-N |