N-[(4-fluorophenyl)methyl]-3-[2-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[2-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
N-[(4-fluorophenyl)methyl]-3-[2-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Compound characteristics
| Compound ID: | K284-3011 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[2-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide |
| Molecular Weight: | 520.58 |
| Molecular Formula: | C27 H25 F N4 O4 S |
| Smiles: | COc1cccc(c1)NC(CSC1=Nc2ccccc2C(N1CCC(NCc1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4037 |
| logD: | 3.4037 |
| logSw: | -3.9138 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.914 |
| InChI Key: | KLUGAWNHHNPCEJ-UHFFFAOYSA-N |