methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
Compound ID: | K289-0255 |
Compound Name: | methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
Molecular Weight: | 472.56 |
Molecular Formula: | C24 H28 N2 O6 S |
Smiles: | CCOC(CC(CSC1=Nc2cc(ccc2C(N1CCC1CCCCC=1)=O)C(=O)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6105 |
logD: | 3.6104 |
logSw: | -3.8431 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 80.301 |
InChI Key: | QDNYVLZXLFLJNG-UHFFFAOYSA-N |