3-[4-(azepan-1-yl)-4-oxobutyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[4-(azepan-1-yl)-4-oxobutyl]quinazolin-4(3H)-one
3-[4-(azepan-1-yl)-4-oxobutyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-2799 |
| Compound Name: | 3-[4-(azepan-1-yl)-4-oxobutyl]quinazolin-4(3H)-one |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C18 H23 N3 O2 |
| Smiles: | C1CCCN(CC1)C(CCCN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2657 |
| logD: | 1.2657 |
| logSw: | -2.0301 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.041 |
| InChI Key: | SXMKWGKUFJUXOF-UHFFFAOYSA-N |