2-[(cyanomethyl)sulfanyl]-4-oxo-3-[(oxolan-2-yl)methyl]-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-[(cyanomethyl)sulfanyl]-4-oxo-3-[(oxolan-2-yl)methyl]-N-propyl-3,4-dihydroquinazoline-7-carboxamide
2-[(cyanomethyl)sulfanyl]-4-oxo-3-[(oxolan-2-yl)methyl]-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G836-0181 |
| Compound Name: | 2-[(cyanomethyl)sulfanyl]-4-oxo-3-[(oxolan-2-yl)methyl]-N-propyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C19 H22 N4 O3 S |
| Smiles: | CCCNC(c1ccc2C(N(CC3CCCO3)C(=Nc2c1)SCC#N)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2405 |
| logD: | 1.2405 |
| logSw: | -2.5655 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.715 |
| InChI Key: | LGSLMPDNLRPHOJ-CQSZACIVSA-N |