| MolName | (5Z)-3-(furan-2-ylmethyl)-5-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one |
| MolecularFormula | C29H26N4O4S |
| Smiles | O=C(Cn1c(cccc2)c2c(/C=C(/C(N2Cc3ccco3)=O)\S/C2=N\c2ccccc2)c1)N1CCOCC1 |
| InChI | InChI=1S/C29H26N4O4S/c34-27(31-12-15-36-16-13-31)20-32-18-21(24-10-4-5-11-25(24)32)17-26-28(35)33(19-23-9-6-14-37-23)29(38-26)30-22-7-2-1-3-8-22/h1-11,14,17-18H,12-13,15-16,19-20H2 |
| InChIK | MJEUQPXXEKQEFI-UHFFFAOYSA-N |
| TotalMolweight | 526.615 |
| Molweight | 526.615 |
| MonoisotopicMass | 526.167476 |
| CLogP | 3.1307 |
| CLogS | -4.375 |
| H Acceptors | 8 |
| TotalSurfaceArea | 393.1 |
| Relative PSA | 0.23699 |
| PolarSurfaceArea | 105.58 |
| Druglikeness | 4.4207 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47368 |
| Fragments | 1 |
| Non HAtoms | 38 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 6 |
| Rings Closures | 6 |
| Small Rings | 6 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 8 |
| Symmetricatoms | 4 |
| Amides | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (5Z)-3-(furan-2-ylmethyl)-5-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one | 2 - (5Z)-3-(furan-2-ylmethyl)-5-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one