N'-(2-chloro-4-methylphenyl)-N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptylthiourea
Chemical Structure Depiction of
N'-(2-chloro-4-methylphenyl)-N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptylthiourea
N'-(2-chloro-4-methylphenyl)-N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptylthiourea
Compound characteristics
| Compound ID: | K788-4236 |
| Compound Name: | N'-(2-chloro-4-methylphenyl)-N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptylthiourea |
| Molecular Weight: | 500.53 |
| Molecular Formula: | C27 H31 Cl2 N3 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(N(Cc1cccn1Cc1ccccc1[Cl])C1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 8.6111 |
| logD: | 8.6111 |
| logSw: | -6.6064 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 11.3761 |
| InChI Key: | HNPAIADLDGXBGX-UHFFFAOYSA-N |