(2-methoxyphenyl)[2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone
Chemical Structure Depiction of
(2-methoxyphenyl)[2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone
(2-methoxyphenyl)[2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone
Compound characteristics
| Compound ID: | C297-0099 |
| Compound Name: | (2-methoxyphenyl)[2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C26 H24 N2 O3 S |
| Smiles: | Cc1ccc(cc1)N1C(N(C2CC1(C)Oc1ccccc12)C(c1ccccc1OC)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9306 |
| logD: | 4.9306 |
| logSw: | -4.7402 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 30.5141 |
| InChI Key: | VAOVXTVAAMLSRD-UHFFFAOYSA-N |