[(Z)-(1-amino-2-thiophen-2-ylsulfonylethylidene)amino] N-phenylcarbamate
Formula:C13H13N3O4S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-(1-amino-2-thiophen-2-ylsulfonylethylidene)amino] N-phenylcarbamate is a drug-like molecule.
| MolName | [(Z)-(1-amino-2-thiophen-2-ylsulfonylethylidene)amino] N-phenylcarbamate |
| MolecularFormula | C13H13N3O4S2 |
| Smiles | N/C(/CS(c1cccs1)(=O)=O)=N\OC(Nc1ccccc1)=O |
| InChI | InChI=1S/C13H13N3O4S2/c14-11(9-22(18,19)12-7-4-8-21-12)16-20-13(17)15-10-5-2-1-3-6-10/h1-8H,9H2,(H2,14,16)(H,15,17) |
| InChIK | ANENZXZQBBPGDN-UHFFFAOYSA-N |
| TotalMolweight | 339.395 |
| Molweight | 339.395 |
| MonoisotopicMass | 339.034747 |
| CLogP | 1.7927 |
| CLogS | -4.08 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 242 |
| Relative PSA | 0.45545 |
| PolarSurfaceArea | 147.47 |
| Druglikeness | -8.8963 |
| 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 | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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1 - [(Z)-(1-amino-2-thiophen-2-ylsulfonylethylidene)amino] N-phenylcarbamate | 2 - [(Z)-(1-amino-2-thiophen-2-ylsulfonylethylidene)amino] N-phenylcarbamate
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