| MolName | [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-(4-chlorophenyl)carbamate |
| MolecularFormula | C13H8N4O2Cl2S |
| Smiles | O=C(Nc(cc1)ccc1Cl)O/N=C\c(n(ccs1)c1n1)c1Cl |
| InChI | InChI=1S/C13H8Cl2N4O2S/c14-8-1-3-9(4-2-8)17-13(20)21-16-7-10-11(15)18-12-19(10)5-6-22-12/h1-7H,(H,17,20) |
| InChIK | JZOHOXZAVYUFKN-UHFFFAOYSA-N |
| TotalMolweight | 355.205 |
| Molweight | 355.205 |
| MonoisotopicMass | 353.9745 |
| CLogP | 4.3486 |
| CLogS | -4.297 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 247.78 |
| Relative PSA | 0.34422 |
| PolarSurfaceArea | 96.23 |
| Druglikeness | -4.1623 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 14 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-(4-chlorophenyl)carbamate | 2 - [(Z)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] N-(4-chlorophenyl)carbamate