N~1~,N~3~-dibenzyl-2-[(7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
Chemical Structure Depiction of
N~1~,N~3~-dibenzyl-2-[(7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
N~1~,N~3~-dibenzyl-2-[(7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
Compound characteristics
| Compound ID: | K284-1074 |
| Compound Name: | N~1~,N~3~-dibenzyl-2-[(7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide |
| Molecular Weight: | 651.79 |
| Molecular Formula: | C36 H37 N5 O5 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(NCc1ccco1)=O)SC(C(NCc1ccccc1)=O)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1236 |
| logD: | 5.1235 |
| logSw: | -4.8606 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.281 |
| InChI Key: | ZJQNHYIKLYSKEB-UHFFFAOYSA-N |