N'-(5-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(4-methylpiperidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N'-(5-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(4-methylpiperidin-1-yl)propyl]thiourea
N'-(5-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(4-methylpiperidin-1-yl)propyl]thiourea
Compound characteristics
Compound ID: | C087-0172 |
Compound Name: | N'-(5-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(4-methylpiperidin-1-yl)propyl]thiourea |
Molecular Weight: | 420.02 |
Molecular Formula: | C22 H30 Cl N3 O S |
Smiles: | CC1CCN(CCCN(Cc2ccco2)C(Nc2cc(ccc2C)[Cl])=S)CC1 |
Stereo: | ACHIRAL |
logP: | 5.4299 |
logD: | 3.5027 |
logSw: | -5.9044 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 21.4398 |
InChI Key: | SHPAVQDKKSIYTD-UHFFFAOYSA-N |