N-benzyl-N'-(2-chloro-4-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Chemical Structure Depiction of
N-benzyl-N'-(2-chloro-4-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
N-benzyl-N'-(2-chloro-4-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Compound characteristics
| Compound ID: | K788-3834 |
| Compound Name: | N-benzyl-N'-(2-chloro-4-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea |
| Molecular Weight: | 494.49 |
| Molecular Formula: | C27 H25 Cl2 N3 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(N(Cc1ccccc1)Cc1cccn1Cc1cccc(c1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 7.6481 |
| logD: | 7.6481 |
| logSw: | -6.5993 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 11.8004 |
| InChI Key: | GSSVCDOJGXSLCZ-UHFFFAOYSA-N |