N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-cyclohexylthiourea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-cyclohexylthiourea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-cyclohexylthiourea
Compound characteristics
| Compound ID: | Y501-6778 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-cyclohexylthiourea |
| Molecular Weight: | 292.4 |
| Molecular Formula: | C15 H20 N2 O2 S |
| Smiles: | C1CCC(CC1)NC(NCc1ccc2c(c1)OCO2)=S |
| Stereo: | ACHIRAL |
| logP: | 3.2087 |
| logD: | 3.2087 |
| logSw: | -3.2821 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.546 |
| InChI Key: | PBULOHFPQRXAHO-UHFFFAOYSA-N |