(Z)-N-[4-(morpholin-4-yldiazenyl)phenyl]sulfonyl-3-phenyl-N-[(E)-3-phenylprop-2-enoyl]prop-2-enamide
Formula:C28H26N4O5S
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
(Z)-N-[4-(morpholin-4-yldiazenyl)phenyl]sulfonyl-3-phenyl-N-[(E)-3-phenylprop-2-enoyl]prop-2-enamide is not a drug-like molecule.
| MolName | (Z)-N-[4-(morpholin-4-yldiazenyl)phenyl]sulfonyl-3-phenyl-N-[(E)-3-phenylprop-2-enoyl]prop-2-enamide |
| MolecularFormula | C28H26N4O5S |
| Smiles | O=C(/C=C/c1ccccc1)N(C(/C=C\c1ccccc1)=O)S(c(cc1)ccc1/N=N/N1CCOCC1)(=O)=O |
| InChI | InChI=1S/C28H26N4O5S/c33-27(17-11-23-7-3-1-4-8-23)32(28(34)18-12-24-9-5-2-6-10-24)38(35,36)26-15-13-25(14-16-26)29-30-31-19-21-37-22-20-31/h1-18H,19-22H2 |
| InChIK | PANWASRJJZJYOS-UHFFFAOYSA-N |
| TotalMolweight | 530.603 |
| Molweight | 530.603 |
| MonoisotopicMass | 530.162391 |
| CLogP | 4.9262 |
| CLogS | -4.633 |
| H Acceptors | 9 |
| TotalSurfaceArea | 405.02 |
| Relative PSA | 0.23401 |
| PolarSurfaceArea | 117.09 |
| Druglikeness | -7.1993 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 38 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 9 |
| Amides | 1 |
| StereoCon |
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1 - (Z)-N-[4-(morpholin-4-yldiazenyl)phenyl]sulfonyl-3-phenyl-N-[(E)-3-phenylprop-2-enoyl]prop-2-enamide | 2 - (Z)-N-[4-(morpholin-4-yldiazenyl)phenyl]sulfonyl-3-phenyl-N-[(E)-3-phenylprop-2-enoyl]prop-2-enamide
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