N'-(3-chloro-4-fluorophenyl)-N-({1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-(2-phenylethyl)thiourea
Chemical Structure Depiction of
N'-(3-chloro-4-fluorophenyl)-N-({1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-(2-phenylethyl)thiourea
N'-(3-chloro-4-fluorophenyl)-N-({1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-(2-phenylethyl)thiourea
Compound characteristics
| Compound ID: | K788-3703 |
| Compound Name: | N'-(3-chloro-4-fluorophenyl)-N-({1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-(2-phenylethyl)thiourea |
| Molecular Weight: | 530.47 |
| Molecular Formula: | C27 H23 Cl2 F2 N3 S |
| Smiles: | C(CN(Cc1cccn1Cc1ccc(cc1[Cl])F)C(Nc1ccc(c(c1)[Cl])F)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.8263 |
| logD: | 7.8262 |
| logSw: | -6.9118 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.4767 |
| InChI Key: | QGLOQIRXXVUBQI-UHFFFAOYSA-N |