2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0866 |
| Compound Name: | 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-(prop-2-en-1-yl)quinazolin-4(3H)-one |
| Molecular Weight: | 316.42 |
| Molecular Formula: | C17 H20 N2 O2 S |
| Smiles: | CC(C)(C)C(CSC1=Nc2ccccc2C(N1CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1776 |
| logD: | 3.1776 |
| logSw: | -3.675 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.539 |
| InChI Key: | SUJFCCYWLRJDAQ-UHFFFAOYSA-N |