| MolName | (Z)-N-[(4-chlorophenyl)methoxy]-1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methanimine |
| MolecularFormula | C21H20N3O2ClS |
| Smiles | Clc1ccc(CO/N=C\c2c(-c3ccccc3)nc(N3CCOCC3)s2)cc1 |
| InChI | InChI=1S/C21H20ClN3O2S/c22-18-8-6-16(7-9-18)15-27-23-14-19-20(17-4-2-1-3-5-17)24-21(28-19)25-10-12-26-13-11-25/h1-9,14H,10-13,15H2 |
| InChIK | CQZLVIQPFMQQDP-UHFFFAOYSA-N |
| TotalMolweight | 413.928 |
| Molweight | 413.928 |
| MonoisotopicMass | 413.096474 |
| CLogP | 5.5684 |
| CLogS | -6.102 |
| H Acceptors | 5 |
| TotalSurfaceArea | 313.26 |
| Relative PSA | 0.21193 |
| PolarSurfaceArea | 75.19 |
| Druglikeness | 3.7383 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 7 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (Z)-N-[(4-chlorophenyl)methoxy]-1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methanimine | 2 - (Z)-N-[(4-chlorophenyl)methoxy]-1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methanimine