N'-(5-chloro-2-methoxyphenyl)-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N'-(5-chloro-2-methoxyphenyl)-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N'-(5-chloro-2-methoxyphenyl)-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | K788-6462 |
| Compound Name: | N'-(5-chloro-2-methoxyphenyl)-N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 531.55 |
| Molecular Formula: | C27 H32 Cl2 N4 O S |
| Smiles: | COc1ccc(cc1NC(N(CCCN1CCCC1)Cc1cccn1Cc1ccc(cc1)[Cl])=S)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.357 |
| logD: | 3.8603 |
| logSw: | -6.3151 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.7578 |
| InChI Key: | SZIPVVXYPIVSBZ-UHFFFAOYSA-N |