N-[(3-chlorophenyl)methyl]-4-[2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-4-[2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-[(3-chlorophenyl)methyl]-4-[2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3494 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-4-[2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 524.01 |
| Molecular Formula: | C27 H23 Cl F N3 O3 S |
| Smiles: | C(CC(NCc1cccc(c1)[Cl])=O)CN1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9086 |
| logD: | 3.9086 |
| logSw: | -4.3078 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.468 |
| InChI Key: | WABKJMFVQZKRMV-UHFFFAOYSA-N |