4-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Chemical Structure Depiction of
4-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)butanamide
4-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Compound characteristics
| Compound ID: | K284-3520 |
| Compound Name: | 4-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)butanamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C26 H28 N6 O3 S |
| Smiles: | Cc1cc(NC(CSC2=Nc3ccccc3C(N2CCCC(NCCc2ccccc2)=O)=O)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.802 |
| logD: | 1.8002 |
| logSw: | -2.8103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.347 |
| InChI Key: | PWTFFAPUBSIQNU-UHFFFAOYSA-N |