N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2,3-dimethylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2,3-dimethylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2,3-dimethylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | K788-6438 |
| Compound Name: | N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2,3-dimethylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 495.13 |
| Molecular Formula: | C28 H35 Cl N4 S |
| Smiles: | Cc1cccc(c1C)NC(N(CCCN1CCCC1)Cc1cccn1Cc1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 6.7347 |
| logD: | 4.2379 |
| logSw: | -6.6118 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 16.1274 |
| InChI Key: | HQVUEPQNQBOETO-UHFFFAOYSA-N |