2-{[(3-chlorophenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(3-chlorophenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | G836-0438 |
Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 458.02 |
Molecular Formula: | C24 H28 Cl N3 O2 S |
Smiles: | CC(C)CNC(c1ccc2C(N(CC(C)C)C(=Nc2c1)SCc1cccc(c1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.4655 |
logD: | 5.4655 |
logSw: | -5.7929 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.727 |
InChI Key: | LQYPGIXJQGJDFS-UHFFFAOYSA-N |