methyl 5-[({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-[({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]furan-2-carboxylate
methyl 5-[({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]furan-2-carboxylate
Compound characteristics
| Compound ID: | Y503-4363 |
| Compound Name: | methyl 5-[({3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]furan-2-carboxylate |
| Molecular Weight: | 486.98 |
| Molecular Formula: | C23 H23 Cl N4 O4 S |
| Smiles: | Cc1c(c(C)n(CCCN2C(=Nc3ccccc3C2=O)SCc2ccc(C(=O)OC)o2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.638 |
| logD: | 3.638 |
| logSw: | -4.3287 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.296 |
| InChI Key: | MPVPXXUXVLYOCO-UHFFFAOYSA-N |