N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(phenylcarbamoylamino)benzamide
Formula:C23H20N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(phenylcarbamoylamino)benzamide is a drug-like molecule.
| MolName | N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(phenylcarbamoylamino)benzamide |
| MolecularFormula | C23H20N4O2 |
| Smiles | O=C(c(cc1)ccc1NC(Nc1ccccc1)=O)N/N=C(/CC1)\c2c1cccc2 |
| InChI | InChI=1S/C23H20N4O2/c28-22(27-26-21-15-12-16-6-4-5-9-20(16)21)17-10-13-19(14-11-17)25-23(29)24-18-7-2-1-3-8-18/h1-11,13-14H,12,15H2,(H,27,28)(H2,24,25,29) |
| InChIK | XVLXXPHIZUHDRR-UHFFFAOYSA-N |
| TotalMolweight | 384.438 |
| Molweight | 384.438 |
| MonoisotopicMass | 384.158626 |
| CLogP | 4.6737 |
| CLogS | -6.428 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 299.65 |
| Relative PSA | 0.24018 |
| PolarSurfaceArea | 82.59 |
| Druglikeness | 2.8357 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(phenylcarbamoylamino)benzamide | 2 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(phenylcarbamoylamino)benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off