N-{3-[butyl(methyl)amino]propyl}-N'-(2,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]propyl}-N'-(2,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
N-{3-[butyl(methyl)amino]propyl}-N'-(2,5-dimethylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0628 |
| Compound Name: | N-{3-[butyl(methyl)amino]propyl}-N'-(2,5-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)ccc1C)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4399 |
| logD: | 3.4344 |
| logSw: | -5.2271 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 15.0709 |
| InChI Key: | UNULHWMRBCSCAS-UHFFFAOYSA-N |