N-cycloheptyl-N'-(2,6-dimethylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Chemical Structure Depiction of
N-cycloheptyl-N'-(2,6-dimethylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
N-cycloheptyl-N'-(2,6-dimethylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Compound characteristics
| Compound ID: | K788-3726 |
| Compound Name: | N-cycloheptyl-N'-(2,6-dimethylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea |
| Molecular Weight: | 473.72 |
| Molecular Formula: | C30 H39 N3 S |
| Smiles: | Cc1ccc(Cn2cccc2CN(C2CCCCCC2)C(Nc2c(C)cccc2C)=S)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.3134 |
| logD: | 8.3134 |
| logSw: | -5.6519 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 10.6783 |
| InChI Key: | XNPZWANHZWUGOD-UHFFFAOYSA-N |