3-benzyl-N-(2-methoxyethyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-N-(2-methoxyethyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-N-(2-methoxyethyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | G836-0033 |
Compound Name: | 3-benzyl-N-(2-methoxyethyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 473.59 |
Molecular Formula: | C27 H27 N3 O3 S |
Smiles: | Cc1cccc(CSC2=Nc3cc(ccc3C(N2Cc2ccccc2)=O)C(NCCOC)=O)c1 |
Stereo: | ACHIRAL |
logP: | 4.725 |
logD: | 4.725 |
logSw: | -4.507 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.64 |
InChI Key: | BYHPXXYYEBICMJ-UHFFFAOYSA-N |