N-(3-chloro-4-fluorophenyl)-2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
N-(3-chloro-4-fluorophenyl)-2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y503-4294 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 492.36 |
| Molecular Formula: | C21 H16 Cl2 F N5 O2 S |
| Smiles: | C(Cn1cc(cn1)[Cl])N1C(=Nc2ccccc2C1=O)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7945 |
| logD: | 3.7896 |
| logSw: | -4.3402 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.654 |
| InChI Key: | OVYZQFWMUBCIPK-UHFFFAOYSA-N |