[(E)-[1-amino-2-(furan-2-ylmethylsulfonyl)ethylidene]amino] N-(4-chlorophenyl)carbamate
Formula:C14H14N3O5ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(E)-[1-amino-2-(furan-2-ylmethylsulfonyl)ethylidene]amino] N-(4-chlorophenyl)carbamate is a drug-like molecule.
| MolName | [(E)-[1-amino-2-(furan-2-ylmethylsulfonyl)ethylidene]amino] N-(4-chlorophenyl)carbamate |
| MolecularFormula | C14H14N3O5ClS |
| Smiles | N/C(/CS(Cc1ccco1)(=O)=O)=N/OC(Nc(cc1)ccc1Cl)=O |
| InChI | InChI=1S/C14H14ClN3O5S/c15-10-3-5-11(6-4-10)17-14(19)23-18-13(16)9-24(20,21)8-12-2-1-7-22-12/h1-7H,8-9H2,(H2,16,18)(H,17,19) |
| InChIK | PVFFBTYZUJFSOG-UHFFFAOYSA-N |
| TotalMolweight | 371.8 |
| Molweight | 371.8 |
| MonoisotopicMass | 371.034269 |
| CLogP | 1.5776 |
| CLogS | -4.699 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 264.93 |
| Relative PSA | 0.39244 |
| PolarSurfaceArea | 132.37 |
| Druglikeness | -6.5305 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 7 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 4 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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