[10-methoxy-2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[10-methoxy-2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl](thiophen-2-yl)methanone
[10-methoxy-2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | C297-0022 |
| Compound Name: | [10-methoxy-2-methyl-3-(4-methylphenyl)-4-sulfanylidene-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C24 H22 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)N1C(N(C2CC1(C)Oc1c2cccc1OC)C(c1cccs1)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8857 |
| logD: | 4.8857 |
| logSw: | -4.7066 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 31.2168 |
| InChI Key: | FRVUDJJOHMBBDZ-UHFFFAOYSA-N |