5-(3-bromophenyl)-3-phenylpyridazine

C16H11BrN2 — CID 10470683

IUPAC5-(3-bromophenyl)-3-phenylpyridazine
SMILESBrc1cccc(-c2cnnc(-c3ccccc3)c2)c1
InChIInChI=1S/C16H11BrN2/c17-15-8-4-7-13(9-15)14-10-16(19-18-11-14)12-5-2-1-3-6-12/h1-11H
InChIKeyDWEPHBCGVLXMBR-UHFFFAOYSA-N
MW311.18 g/mol
LogP4.57
Rot. Bonds2

About 5-(3-bromophenyl)-3-phenylpyridazine

5-(3-bromophenyl)-3-phenylpyridazine (PubChem CID 10470683) has the molecular formula C16H11BrN2 and a molecular weight of 311.18 g/mol. Its IUPAC name is 5-(3-bromophenyl)-3-phenylpyridazine.

Molecular Properties

Compound Name5-(3-bromophenyl)-3-phenylpyridazine
PubChem CID10470683
Molecular FormulaC16H11BrN2
Molecular Weight311.18 g/mol
Exact Mass310.01
IUPAC Name5-(3-bromophenyl)-3-phenylpyridazine
SMILESBrc1cccc(-c2cnnc(-c3ccccc3)c2)c1
InChIInChI=1S/C16H11BrN2/c17-15-8-4-7-13(9-15)14-10-16(19-18-11-14)12-5-2-1-3-6-12/h1-11H
InChIKeyDWEPHBCGVLXMBR-UHFFFAOYSA-N
XLogP4.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.18
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Phenylpyridazine
CID 193499
3-Methyl-5-phenylpyridazine
CID 2736934
3-(6-Phenyl-pyridazin-4-yl)-benzonitrile
CID 10400221
3,5-Diphenylpyridazine
CID 10443943
4-(6-Phenyl-pyridazin-4-yl)-benzonitrile
CID 11521728
2-(6-Phenyl-pyridazin-4-yl)-benzonitrile
CID 11586937
5-Bromo-3-phenylpyridazine
CID 11042692
3-(5-Phenyl-pyridazin-3-yl)-benzonitrile
CID 11608571
3-Benzylpyridazine
CID 598149
3,6-Bis[p-bromophenyl]pyridazine
CID 602719
3-(2-Phenylethyl)pyridazine
CID 603096
Phenyl-pyridazinyl-ethene
CID 15684263

Frequently Asked Questions

What is the IUPAC name of 5-(3-bromophenyl)-3-phenylpyridazine?
The IUPAC name of 5-(3-bromophenyl)-3-phenylpyridazine (CID 10470683) is 5-(3-bromophenyl)-3-phenylpyridazine.
What is the SMILES notation for 5-(3-bromophenyl)-3-phenylpyridazine?
The canonical SMILES for 5-(3-bromophenyl)-3-phenylpyridazine is Brc1cccc(-c2cnnc(-c3ccccc3)c2)c1.
What is the InChIKey of 5-(3-bromophenyl)-3-phenylpyridazine?
The InChIKey is DWEPHBCGVLXMBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11BrN2/c17-15-8-4-7-13(9-15)14-10-16(19-18-11-14)12-5-2-1-3-6-12/h1-11H.
What are the key properties of 5-(3-bromophenyl)-3-phenylpyridazine?
5-(3-bromophenyl)-3-phenylpyridazine has a molecular weight of 311.18 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-bromophenyl)-3-phenylpyridazine is sourced from PubChem (CID 10470683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).