N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Chemical Structure Depiction of
N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Compound characteristics
| Compound ID: | K788-3249 |
| Compound Name: | N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea |
| Molecular Weight: | 488.09 |
| Molecular Formula: | C29 H30 Cl N3 S |
| Smiles: | Cc1ccc(Cn2cccc2CN(Cc2ccccc2)C(Nc2cccc(c2C)[Cl])=S)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.1479 |
| logD: | 8.1479 |
| logSw: | -6.6286 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 11.8004 |
| InChI Key: | QDQPWFUTUNXALT-UHFFFAOYSA-N |