methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
Compound ID: | K284-0236 |
Compound Name: | methyl 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
Molecular Weight: | 442.58 |
Molecular Formula: | C24 H30 N2 O4 S |
Smiles: | CC(C)(C)C(CSC1=Nc2cc(ccc2C(N1CCC1CCCCC=1)=O)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 4.9404 |
logD: | 4.9404 |
logSw: | -4.6165 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 60.634 |
InChI Key: | OJXXHYMNIYNWTO-UHFFFAOYSA-N |