N~1~,N~3~-dibenzyl-2-[(7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
Chemical Structure Depiction of
N~1~,N~3~-dibenzyl-2-[(7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
N~1~,N~3~-dibenzyl-2-[(7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide
Compound characteristics
| Compound ID: | K284-1064 |
| Compound Name: | N~1~,N~3~-dibenzyl-2-[(7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanediamide |
| Molecular Weight: | 679.88 |
| Molecular Formula: | C39 H45 N5 O4 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(NCCC1CCCCC=1)=O)SC(C(NCc1ccccc1)=O)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6769 |
| logD: | 5.6769 |
| logSw: | -5.2649 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.566 |
| InChI Key: | QYIZTHBADBODRX-UHFFFAOYSA-N |