N-[(4-fluorophenyl)methyl]-3-[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
N-[(4-fluorophenyl)methyl]-3-[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Compound characteristics
| Compound ID: | K284-3014 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide |
| Molecular Weight: | 504.58 |
| Molecular Formula: | C27 H25 F N4 O3 S |
| Smiles: | Cc1ccc(cc1)NC(CSC1=Nc2ccccc2C(N1CCC(NCc1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7606 |
| logD: | 3.7606 |
| logSw: | -3.9337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.37 |
| InChI Key: | BIJUZBOFNWZUPS-UHFFFAOYSA-N |