[(Z)-[amino-[4-(3,5-dichloropyridin-4-yl)oxyphenyl]methylidene]amino] N-phenylcarbamate
Formula:C19H14N4O3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-[amino-[4-(3,5-dichloropyridin-4-yl)oxyphenyl]methylidene]amino] N-phenylcarbamate is a drug-like molecule.
| MolName | [(Z)-[amino-[4-(3,5-dichloropyridin-4-yl)oxyphenyl]methylidene]amino] N-phenylcarbamate |
| MolecularFormula | C19H14N4O3Cl2 |
| Smiles | N/C(/c(cc1)ccc1Oc(c(Cl)cnc1)c1Cl)=N\OC(Nc1ccccc1)=O |
| InChI | InChI=1S/C19H14Cl2N4O3/c20-15-10-23-11-16(21)17(15)27-14-8-6-12(7-9-14)18(22)25-28-19(26)24-13-4-2-1-3-5-13/h1-11H,(H2,22,25)(H,24,26) |
| InChIK | MKRIHGWHACWKMD-UHFFFAOYSA-N |
| TotalMolweight | 417.251 |
| Molweight | 417.251 |
| MonoisotopicMass | 416.044295 |
| CLogP | 4.6727 |
| CLogS | -7.026 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 303.08 |
| Relative PSA | 0.27138 |
| PolarSurfaceArea | 98.83 |
| Druglikeness | -5.6459 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - [(Z)-[amino-[4-(3,5-dichloropyridin-4-yl)oxyphenyl]methylidene]amino] N-phenylcarbamate | 2 - [(Z)-[amino-[4-(3,5-dichloropyridin-4-yl)oxyphenyl]methylidene]amino] N-phenylcarbamate
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