N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3-chlorophenyl)thiourea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3-chlorophenyl)thiourea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3-chlorophenyl)thiourea
Compound characteristics
Compound ID: | 3805-1108 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3-chlorophenyl)thiourea |
Molecular Weight: | 320.8 |
Molecular Formula: | C15 H13 Cl N2 O2 S |
Smiles: | C(c1ccc2c(c1)OCO2)NC(Nc1cccc(c1)[Cl])=S |
Stereo: | ACHIRAL |
logP: | 3.8219 |
logD: | 3.8219 |
logSw: | -4.1993 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 37.499 |
InChI Key: | NTFXDMOOCXWCDS-UHFFFAOYSA-N |