1-(4-{4-[4-(azepane-1-carbonyl)thiophene-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[4-(azepane-1-carbonyl)thiophene-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[4-(azepane-1-carbonyl)thiophene-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F540-1690 |
| Compound Name: | 1-(4-{4-[4-(azepane-1-carbonyl)thiophene-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 475.63 |
| Molecular Formula: | C23 H29 N3 O4 S2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1cc(cs1)C(N1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0236 |
| logD: | 3.0236 |
| logSw: | -3.2744 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.034 |
| InChI Key: | KQHUKUXOJJKKKT-UHFFFAOYSA-N |