N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-benzyl-N'-(4-methoxyphenyl)thiourea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-benzyl-N'-(4-methoxyphenyl)thiourea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-benzyl-N'-(4-methoxyphenyl)thiourea
Compound characteristics
| Compound ID: | 4492-0018 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-benzyl-N'-(4-methoxyphenyl)thiourea |
| Molecular Weight: | 406.5 |
| Molecular Formula: | C23 H22 N2 O3 S |
| Smiles: | COc1ccc(cc1)NC(N(Cc1ccccc1)Cc1ccc2c(c1)OCO2)=S |
| Stereo: | ACHIRAL |
| logP: | 4.9568 |
| logD: | 4.9568 |
| logSw: | -4.6826 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.087 |
| InChI Key: | DKYAIEXKBSSYEO-UHFFFAOYSA-N |