2-({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-hexylacetamide
Chemical Structure Depiction of
2-({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-hexylacetamide
2-({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-hexylacetamide
Compound characteristics
| Compound ID: | Y503-4355 |
| Compound Name: | 2-({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-hexylacetamide |
| Molecular Weight: | 490.07 |
| Molecular Formula: | C24 H32 Cl N5 O2 S |
| Smiles: | CCCCCCNC(CSC1=Nc2ccccc2C(N1CCCn1c(C)c(c(C)n1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8385 |
| logD: | 3.8385 |
| logSw: | -4.4471 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.866 |
| InChI Key: | CLRBBQJIEYEDIB-UHFFFAOYSA-N |