N-{3-[bis(2-methylpropyl)amino]propyl}-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethylphenyl)thiourea
Chemical Structure Depiction of
N-{3-[bis(2-methylpropyl)amino]propyl}-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethylphenyl)thiourea
N-{3-[bis(2-methylpropyl)amino]propyl}-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethylphenyl)thiourea
Compound characteristics
| Compound ID: | K788-6378 |
| Compound Name: | N-{3-[bis(2-methylpropyl)amino]propyl}-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethylphenyl)thiourea |
| Molecular Weight: | 553.25 |
| Molecular Formula: | C32 H45 Cl N4 S |
| Smiles: | CCc1ccccc1NC(N(CCCN(CC(C)C)CC(C)C)Cc1cccn1Cc1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 8.6397 |
| logD: | 6.3793 |
| logSw: | -6.7443 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 16.0121 |
| InChI Key: | DZQSEPJATQIUPA-UHFFFAOYSA-N |