N-[2-(benzylsulfanyl)ethyl]-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(benzylsulfanyl)ethyl]-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
N-[2-(benzylsulfanyl)ethyl]-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K221-3097 |
| Compound Name: | N-[2-(benzylsulfanyl)ethyl]-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | C(CSCc1ccccc1)NC(c1ccc(CN2C(c3ccccc3NC2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9996 |
| logD: | 3.9994 |
| logSw: | -4.3859 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.735 |
| InChI Key: | NJYFESOTSIUMRS-UHFFFAOYSA-N |