N-(5-methyl-1H-pyrazol-3-yl)-2-({4-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(5-methyl-1H-pyrazol-3-yl)-2-({4-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
N-(5-methyl-1H-pyrazol-3-yl)-2-({4-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-2890 |
| Compound Name: | N-(5-methyl-1H-pyrazol-3-yl)-2-({4-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C22 H26 N6 O3 S |
| Smiles: | Cc1cc(NC(CSC2=Nc3ccccc3C(N2CCC(N2CCCCC2)=O)=O)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.7266 |
| logD: | 1.7247 |
| logSw: | -2.7809 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.426 |
| InChI Key: | XOVRSVDLBCCQKD-UHFFFAOYSA-N |