N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methoxyphenyl)thiourea
Chemical Structure Depiction of
N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methoxyphenyl)thiourea
N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methoxyphenyl)thiourea
Compound characteristics
| Compound ID: | K788-3722 |
| Compound Name: | N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methoxyphenyl)thiourea |
| Molecular Weight: | 475.7 |
| Molecular Formula: | C29 H37 N3 O S |
| Smiles: | Cc1ccc(Cn2cccc2CN(C2CCCCCC2)C(Nc2ccccc2OC)=S)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.0636 |
| logD: | 8.0636 |
| logSw: | -5.6241 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.0066 |
| InChI Key: | BZROCIWFTGTQQV-UHFFFAOYSA-N |