2-[(Z)-[6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]oxy-1-morpholin-4-ylethanone
Formula:C18H17N4O3BrS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-[6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]oxy-1-morpholin-4-ylethanone is a drug-like molecule.
| MolName | 2-[(Z)-[6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]oxy-1-morpholin-4-ylethanone |
| MolecularFormula | C18H17N4O3BrS |
| Smiles | O=C(CO/N=C\c1c(-c(cc2)ccc2Br)nc2sccn12)N1CCOCC1 |
| InChI | InChI=1S/C18H17BrN4O3S/c19-14-3-1-13(2-4-14)17-15(23-7-10-27-18(23)21-17)11-20-26-12-16(24)22-5-8-25-9-6-22/h1-4,7,10-11H,5-6,8-9,12H2 |
| InChIK | UDXIQCUVQLKKNC-UHFFFAOYSA-N |
| TotalMolweight | 449.328 |
| Molweight | 449.328 |
| MonoisotopicMass | 448.020472 |
| CLogP | 3.3394 |
| CLogS | -3.178 |
| H Acceptors | 7 |
| TotalSurfaceArea | 299.71 |
| Relative PSA | 0.29155 |
| PolarSurfaceArea | 96.67 |
| Druglikeness | 2.709 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59259 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 14 |
| Sp3Atoms | 7 |
| Symmetricatoms | 4 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - 2-[(Z)-[6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]oxy-1-morpholin-4-ylethanone | 2 - 2-[(Z)-[6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]oxy-1-morpholin-4-ylethanone
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