3-(2-Bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole
-
CAS Number 425373-64-4
-
Catalog Number io-406834
-
Molecular Weight 335.5800
-
SMILES C1=CC=C(C(=C1)C2=NOC(=N2)C3=CC=C(C=C3)Cl)Br
| Size | QTY | Notes | |
|---|---|---|---|
|
|
|
Add |
No description available for this item
| 1 | 3-(2-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole |
| 2 | MFCD02216521 |
| 3 | DTXSID50358028 |
| 4 | AKOS015835144 |
| 5 | BS-22965 |
| Molecular Formula | C14H8BrClN2O |
|---|---|
| Canonical SMILES | C1=CC=C(C(=C1)C2=NOC(=N2)C3=CC=C(C=C3)Cl)Br |
| Isomeric SMILES | C1=CC=C(C(=C1)C2=NOC(=N2)C3=CC=C(C=C3)Cl)Br |
| Molecular Weight | 335.5800 |
| InChIKey | UZPFCJFMWDPDJT-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H8BrClN2O/c15-12-4-2-1-3-11(12)13-17-14(19-18-13)9-5-7-10(16)8-6-9/h1-8H |
| XLogP | 4.8000 |
| ExactMass | 333.9509 |
| MonoisotopicMass | 333.9509 |
| TPSA | 38.9000 |
| Complexity | 299.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 3 |
| RotatableBondCount | 2 |
| HeavyAtomCount | 19 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 0 |
| PatentFamilyCount | 0 |
| LiteratureCount | 0 |
