N-{3-[butyl(methyl)amino]propyl}-N'-(3,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]propyl}-N'-(3,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
N-{3-[butyl(methyl)amino]propyl}-N'-(3,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-1291 |
| Compound Name: | N-{3-[butyl(methyl)amino]propyl}-N'-(3,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 403.65 |
| Molecular Formula: | C22 H33 N3 S2 |
| Smiles: | CCCCN(C)CCCN(Cc1cccs1)C(Nc1cc(C)cc(C)c1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.748 |
| logD: | 3.7426 |
| logSw: | -5.4006 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 15.7687 |
| InChI Key: | ZDDFNHCVENFDCK-UHFFFAOYSA-N |