2-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one
2-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | M577-0014 |
| Compound Name: | 2-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one |
| Molecular Weight: | 331.84 |
| Molecular Formula: | C18 H22 Cl N3 O |
| Smiles: | CN1CCCN(CC1)C(Cc1cccn1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8011 |
| logD: | 1.3616 |
| logSw: | -3.287 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.6964 |
| InChI Key: | OAFGLAPFUSKCEI-UHFFFAOYSA-N |