N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-[3-(methylsulfanyl)phenyl]thiourea
Chemical Structure Depiction of
N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-[3-(methylsulfanyl)phenyl]thiourea
N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-[3-(methylsulfanyl)phenyl]thiourea
Compound characteristics
| Compound ID: | K788-5570 |
| Compound Name: | N-({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-cycloheptyl-N'-[3-(methylsulfanyl)phenyl]thiourea |
| Molecular Weight: | 498.15 |
| Molecular Formula: | C27 H32 Cl N3 S2 |
| Smiles: | CSc1cccc(c1)NC(N(Cc1cccn1Cc1ccccc1[Cl])C1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 8.0045 |
| logD: | 8.0045 |
| logSw: | -6.6561 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.074 |
| InChI Key: | WICVONVMWHKLRI-UHFFFAOYSA-N |