2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide
Formula:C24H24N4O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide is a drug-like molecule.
| MolName | 2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide |
| MolecularFormula | C24H24N4O3S |
| Smiles | O=C(Cc1csc(N2CCOCC2)n1)N/N=C(\C1)/c(cccc2)c2OC1c1ccccc1 |
| InChI | InChI=1S/C24H24N4O3S/c29-23(14-18-16-32-24(25-18)28-10-12-30-13-11-28)27-26-20-15-22(17-6-2-1-3-7-17)31-21-9-5-4-8-19(20)21/h1-9,16,22H,10-15H2,(H,27,29)/t22-/m1/s1 |
| InChIK | MGVNTNYVRYNANR-JOCHJYFZSA-N |
| TotalMolweight | 448.546 |
| Molweight | 448.546 |
| MonoisotopicMass | 448.156911 |
| CLogP | 4.1479 |
| CLogS | -5.134 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 338.02 |
| Relative PSA | 0.26889 |
| PolarSurfaceArea | 104.29 |
| Druglikeness | 5.775 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.5625 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 9 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon | racemate |
Click to Load Molecule:
1 - 2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide | 2 - 2-(2-morpholin-4-yl-1,3-thiazol-4-yl)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide
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