1-(azepan-1-yl)-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}ethan-1-one
1-(azepan-1-yl)-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | L958-1015 |
| Compound Name: | 1-(azepan-1-yl)-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}ethan-1-one |
| Molecular Weight: | 399.94 |
| Molecular Formula: | C21 H22 Cl N3 O S |
| Smiles: | C1CCCN(CC1)C(Cn1cccc1c1nc(cs1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6792 |
| logD: | 5.6791 |
| logSw: | -6.0915 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.0137 |
| InChI Key: | MPXBDQCJBXGXRP-UHFFFAOYSA-N |