N'-(4-chloro-2-methoxyphenyl)-N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Chemical Structure Depiction of
N'-(4-chloro-2-methoxyphenyl)-N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
N'-(4-chloro-2-methoxyphenyl)-N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Compound characteristics
| Compound ID: | K788-3721 |
| Compound Name: | N'-(4-chloro-2-methoxyphenyl)-N-cycloheptyl-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea |
| Molecular Weight: | 510.14 |
| Molecular Formula: | C29 H36 Cl N3 O S |
| Smiles: | Cc1ccc(Cn2cccc2CN(C2CCCCCC2)C(Nc2ccc(cc2OC)[Cl])=S)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.9687 |
| logD: | 8.9687 |
| logSw: | -6.4675 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.0066 |
| InChI Key: | SMNNENAWRHQOLF-UHFFFAOYSA-N |