3-[4-(4-tert-butylphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[4-(4-tert-butylphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
3-[4-(4-tert-butylphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | IB05-5834 |
| Compound Name: | 3-[4-(4-tert-butylphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 456.58 |
| Molecular Formula: | C29 H32 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)OCCCCN1C(c2ccc(cc2)OC)=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 6.54 |
| logD: | 6.54 |
| logSw: | -7.37 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.92 |
| InChI Key: | KPQVAVLNCSFDSA-UHFFFAOYSA-N |