4-({3-(2H-1,3-benzodioxol-5-yl)-2-[(2H-1,3-benzodioxol-5-yl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenyl morpholine-4-carboxylate
Chemical Structure Depiction of
4-({3-(2H-1,3-benzodioxol-5-yl)-2-[(2H-1,3-benzodioxol-5-yl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenyl morpholine-4-carboxylate
4-({3-(2H-1,3-benzodioxol-5-yl)-2-[(2H-1,3-benzodioxol-5-yl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenyl morpholine-4-carboxylate
Compound characteristics
| Compound ID: | 4094-0037 |
| Compound Name: | 4-({3-(2H-1,3-benzodioxol-5-yl)-2-[(2H-1,3-benzodioxol-5-yl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenyl morpholine-4-carboxylate |
| Molecular Weight: | 573.58 |
| Molecular Formula: | C29 H23 N3 O8 S |
| Smiles: | C1COCCN1C(=O)Oc1ccc(/C=C2/C(N(/C(=N/c3ccc4c(c3)OCO4)S2)c2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8395 |
| logD: | 4.8395 |
| logSw: | -4.9081 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.989 |
| InChI Key: | TYVDLZASVWGENX-UHFFFAOYSA-N |