4-(1-{3-[4-(butan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(prop-2-en-1-yl)pyrrolidin-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(1-{3-[4-(butan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(prop-2-en-1-yl)pyrrolidin-2-one--hydrogen chloride (1/1)
4-(1-{3-[4-(butan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(prop-2-en-1-yl)pyrrolidin-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-2508 |
| Compound Name: | 4-(1-{3-[4-(butan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(prop-2-en-1-yl)pyrrolidin-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 468.04 |
| Molecular Formula: | C27 H33 N3 O2 |
| Salt: | HCl |
| Smiles: | CCC(C)c1ccc(cc1)OCCCn1c2ccccc2nc1C1CC(N(CC=C)C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.925 |
| logD: | 5.925 |
| logSw: | -5.4496 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.737 |
| InChI Key: | JFCBJJQXBQGVQF-UHFFFAOYSA-N |