N-benzyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(4-methoxyphenyl)thiourea
Chemical Structure Depiction of
N-benzyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(4-methoxyphenyl)thiourea
N-benzyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(4-methoxyphenyl)thiourea
Compound characteristics
| Compound ID: | K788-3261 |
| Compound Name: | N-benzyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(4-methoxyphenyl)thiourea |
| Molecular Weight: | 469.65 |
| Molecular Formula: | C29 H31 N3 O S |
| Smiles: | Cc1ccc(Cn2cccc2CN(Cc2ccccc2)C(Nc2ccc(cc2)OC)=S)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.9793 |
| logD: | 6.9793 |
| logSw: | -5.7109 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 20.042 |
| InChI Key: | QPNVHNDKAMYLSV-UHFFFAOYSA-N |