N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(3,4-dimethylphenyl)thiourea
Chemical Structure Depiction of
N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(3,4-dimethylphenyl)thiourea
N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(3,4-dimethylphenyl)thiourea
Compound characteristics
| Compound ID: | K788-3775 |
| Compound Name: | N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(3,4-dimethylphenyl)thiourea |
| Molecular Weight: | 480.12 |
| Molecular Formula: | C28 H34 Cl N3 S |
| Smiles: | Cc1ccc(cc1C)NC(N(Cc1cccn1Cc1ccccc1[Cl])C1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 8.531 |
| logD: | 8.531 |
| logSw: | -6.6084 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.074 |
| InChI Key: | BHJAMHHYDMWRAB-UHFFFAOYSA-N |