1-{4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | P891-1445 |
| Compound Name: | 1-{4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C19 H21 N5 O2 S |
| Smiles: | Cc1nc(c2cccnc2N2CCCN(CC2)C(Cc2cccs2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.2581 |
| logD: | 2.0323 |
| logSw: | -2.7494 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.24 |
| InChI Key: | GNJAVPVYOOOIMW-UHFFFAOYSA-N |