N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | K788-6463 |
| Compound Name: | N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 481.1 |
| Molecular Formula: | C27 H33 Cl N4 S |
| Smiles: | Cc1ccccc1NC(N(CCCN1CCCC1)Cc1cccn1Cc1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.899 |
| logD: | 3.4023 |
| logSw: | -6.0873 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 16.1274 |
| InChI Key: | XWGJFSBDGXAMGJ-UHFFFAOYSA-N |