(furan-2-yl){10-methoxy-2-methyl-3-[4-(propan-2-yl)phenyl]-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl}methanone
Chemical Structure Depiction of
(furan-2-yl){10-methoxy-2-methyl-3-[4-(propan-2-yl)phenyl]-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl}methanone
(furan-2-yl){10-methoxy-2-methyl-3-[4-(propan-2-yl)phenyl]-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl}methanone
Compound characteristics
| Compound ID: | C297-0024 |
| Compound Name: | (furan-2-yl){10-methoxy-2-methyl-3-[4-(propan-2-yl)phenyl]-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl}methanone |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C26 H26 N2 O4 S |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(C2CC1(C)Oc1c2cccc1OC)C(c1ccco1)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0731 |
| logD: | 5.0731 |
| logSw: | -4.7906 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.777 |
| InChI Key: | HWIGJBLYYNJTEQ-UHFFFAOYSA-N |