3-(3-{4-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]phenyl}-1,2,4-oxadiazol-5-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3-{4-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]phenyl}-1,2,4-oxadiazol-5-yl)-2H-1-benzopyran-2-one
3-(3-{4-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]phenyl}-1,2,4-oxadiazol-5-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | L303-3158 |
| Compound Name: | 3-(3-{4-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]phenyl}-1,2,4-oxadiazol-5-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 534.59 |
| Molecular Formula: | C27 H26 N4 O6 S |
| Smiles: | C1CCN(C1)C(C1CCN(CC1)S(c1ccc(cc1)c1nc(C2=Cc3ccccc3OC2=O)on1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7665 |
| logD: | 3.7665 |
| logSw: | -4.2026 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 101.291 |
| InChI Key: | RJPWTALBVVJHEU-UHFFFAOYSA-N |