N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3,5-dimethylphenyl)thiourea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3,5-dimethylphenyl)thiourea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3,5-dimethylphenyl)thiourea
Compound characteristics
| Compound ID: | Y600-0568 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(3,5-dimethylphenyl)thiourea |
| Molecular Weight: | 314.4 |
| Molecular Formula: | C17 H18 N2 O2 S |
| Smiles: | Cc1cc(C)cc(c1)NC(NCc1ccc2c(c1)OCO2)=S |
| Stereo: | ACHIRAL |
| logP: | 3.7614 |
| logD: | 3.7614 |
| logSw: | -3.9457 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.499 |
| InChI Key: | JOWXEBIOVMVJTB-UHFFFAOYSA-N |