(NZ)-4-chloro-N-(3-morpholin-4-yl-4-oxonaphthalen-1-ylidene)benzenesulfonamide
Formula:C20H17N2O4ClS
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(NZ)-4-chloro-N-(3-morpholin-4-yl-4-oxonaphthalen-1-ylidene)benzenesulfonamide is a drug-like molecule.
| MolName | (NZ)-4-chloro-N-(3-morpholin-4-yl-4-oxonaphthalen-1-ylidene)benzenesulfonamide |
| MolecularFormula | C20H17N2O4ClS |
| Smiles | O=C(c1c2cccc1)C(N1CCOCC1)=C/C2=N/S(c(cc1)ccc1Cl)(=O)=O |
| InChI | InChI=1S/C20H17ClN2O4S/c21-14-5-7-15(8-6-14)28(25,26)22-18-13-19(23-9-11-27-12-10-23)20(24)17-4-2-1-3-16(17)18/h1-8,13H,9-12H2 |
| InChIK | CVJXEVXPCGGWJL-UHFFFAOYSA-N |
| TotalMolweight | 416.884 |
| Molweight | 416.884 |
| MonoisotopicMass | 416.059755 |
| CLogP | 2.9374 |
| CLogS | -4.298 |
| H Acceptors | 6 |
| TotalSurfaceArea | 290.79 |
| Relative PSA | 0.22931 |
| PolarSurfaceArea | 84.42 |
| Druglikeness | 3.0507 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
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