N-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-fluorobenzamide
N-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | K284-4902 |
| Compound Name: | N-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-fluorobenzamide |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C23 H23 F N4 O3 S |
| Smiles: | C1CCC(CC1)NC(CSC1=Nc2ccccc2C(N1NC(c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5436 |
| logD: | 2.5069 |
| logSw: | -2.9306 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.369 |
| InChI Key: | OIVUBYOUNBOEHN-UHFFFAOYSA-N |