N-{3-[butyl(methyl)amino]propyl}-N'-(2-ethyl-6-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]propyl}-N'-(2-ethyl-6-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
N-{3-[butyl(methyl)amino]propyl}-N'-(2-ethyl-6-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0985 |
| Compound Name: | N-{3-[butyl(methyl)amino]propyl}-N'-(2-ethyl-6-methylphenyl)-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 417.68 |
| Molecular Formula: | C23 H35 N3 S2 |
| Smiles: | CCCCN(C)CCCN(Cc1cccs1)C(Nc1c(C)cccc1CC)=S |
| Stereo: | ACHIRAL |
| logP: | 5.8856 |
| logD: | 3.8801 |
| logSw: | -5.4725 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 14.3731 |
| InChI Key: | HHRIVVNBLOBIGD-UHFFFAOYSA-N |