N-({5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(2,4,6-trimethylphenyl)thiourea
Chemical Structure Depiction of
N-({5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(2,4,6-trimethylphenyl)thiourea
N-({5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(2,4,6-trimethylphenyl)thiourea
Compound characteristics
Compound ID: | K788-3815 |
Compound Name: | N-({5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-(2,4,6-trimethylphenyl)thiourea |
Molecular Weight: | 494.14 |
Molecular Formula: | C29 H36 Cl N3 S |
Smiles: | Cc1cc(C)c(c(C)c1)NC(N(Cc1ccc(Cc2ccccc2[Cl])[nH]1)C1CCCCCC1)=S |
Stereo: | ACHIRAL |
logP: | 8.2594 |
logD: | 8.2594 |
logSw: | -6.6033 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 18.9611 |
InChI Key: | BOOKQIRBDQUXCQ-UHFFFAOYSA-N |