N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | V029-7724 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide |
| Molecular Weight: | 472.52 |
| Molecular Formula: | C26 H20 N2 O5 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(/C=C2/C(N(Cc3ccccc3)C(=O)S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6683 |
| logD: | 4.6683 |
| logSw: | -4.8007 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.124 |
| InChI Key: | IUHQSIPGHLHTGN-UHFFFAOYSA-N |