N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Chemical Structure Depiction of
N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea
Compound characteristics
| Compound ID: | K788-3830 |
| Compound Name: | N-benzyl-N'-(3-chloro-2-methylphenyl)-N-({1-[(3-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)thiourea |
| Molecular Weight: | 494.49 |
| Molecular Formula: | C27 H25 Cl2 N3 S |
| Smiles: | Cc1c(cccc1[Cl])NC(N(Cc1ccccc1)Cc1cccn1Cc1cccc(c1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 7.7317 |
| logD: | 7.7317 |
| logSw: | -6.5883 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 11.8004 |
| InChI Key: | ZBXNHTFSNORSHF-UHFFFAOYSA-N |