[(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate
Formula:C14H8N4O2ClF3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate is a drug-like molecule.
| MolName | [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate |
| MolecularFormula | C14H8N4O2ClF3S |
| Smiles | O=C(Nc1cc(C(F)(F)F)ccc1)O/N=C\c(n(ccs1)c1n1)c1Cl |
| InChI | InChI=1S/C14H8ClF3N4O2S/c15-11-10(22-4-5-25-12(22)21-11)7-19-24-13(23)20-9-3-1-2-8(6-9)14(16,17)18/h1-7H,(H,20,23) |
| InChIK | HJRPMSFHUBTOMK-UHFFFAOYSA-N |
| TotalMolweight | 388.757 |
| Molweight | 388.757 |
| MonoisotopicMass | 388.000857 |
| CLogP | 4.5909 |
| CLogS | -4.339 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 261.82 |
| Relative PSA | 0.32576 |
| PolarSurfaceArea | 96.23 |
| Druglikeness | -11.352 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 11 |
| Electronegative Atoms | 11 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 14 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate | 2 - [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off