3-bromo-8-chloro-1,5-naphthyridine

C8H4BrClN2 — CID 13459137

IUPAC3-bromo-8-chloro-1,5-naphthyridine
SMILESClc1ccnc2cc(Br)cnc12
InChIInChI=1S/C8H4BrClN2/c9-5-3-7-8(12-4-5)6(10)1-2-11-7/h1-4H
InChIKeySKKJMLNKELECHI-UHFFFAOYSA-N
MW243.49 g/mol
LogP3.05
Rot. Bonds

About 3-bromo-8-chloro-1,5-naphthyridine

3-bromo-8-chloro-1,5-naphthyridine (PubChem CID 13459137) has the molecular formula C8H4BrClN2 and a molecular weight of 243.49 g/mol. Its IUPAC name is 3-bromo-8-chloro-1,5-naphthyridine.

Molecular Properties

Compound Name3-bromo-8-chloro-1,5-naphthyridine
PubChem CID13459137
Molecular FormulaC8H4BrClN2
Molecular Weight243.49 g/mol
Exact Mass241.92
IUPAC Name3-bromo-8-chloro-1,5-naphthyridine
SMILESClc1ccnc2cc(Br)cnc12
InChIInChI=1S/C8H4BrClN2/c9-5-3-7-8(12-4-5)6(10)1-2-11-7/h1-4H
InChIKeySKKJMLNKELECHI-UHFFFAOYSA-N
XLogP3.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.49
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-bromo-4-chloropyrido[3,2-c]pyridazine
CID 162682576
3-bromo-5,8-dichloroquinoline
CID 67706572
3-bromo-8-(3-methylbutan-2-ylsulfanyl)-1,5-naphthyridine
CID 107754017
7-bromo-N-(3-chloro-5-fluorophenyl)-1,5-naphthyridin-4-amine
CID 107370356
5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine
CID 103098993
2-(7-bromo-1,5-naphthyridin-4-yl)propanoic acid
CID 104571211
7-bromo-N-(2-bromoethyl)-N-propan-2-yl-1,5-naphthyridin-4-amine
CID 113394590
2-bromo-8-chloro-1,5-naphthyridine
CID 96880051
3-bromo-8-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,5-naphthyridine
CID 102722622
2-bromo-8-chloro-3-methoxy-1,5-naphthyridine
CID 139349489
3-bromo-8-chloroquinoline;tetramethylazanium
CID 67706558
7-bromo-N-(1-chloro-4-methylpentan-2-yl)-1,5-naphthyridin-4-amine
CID 113394587

Frequently Asked Questions

What is the IUPAC name of 3-bromo-8-chloro-1,5-naphthyridine?
The IUPAC name of 3-bromo-8-chloro-1,5-naphthyridine (CID 13459137) is 3-bromo-8-chloro-1,5-naphthyridine.
What is the SMILES notation for 3-bromo-8-chloro-1,5-naphthyridine?
The canonical SMILES for 3-bromo-8-chloro-1,5-naphthyridine is Clc1ccnc2cc(Br)cnc12.
What is the InChIKey of 3-bromo-8-chloro-1,5-naphthyridine?
The InChIKey is SKKJMLNKELECHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4BrClN2/c9-5-3-7-8(12-4-5)6(10)1-2-11-7/h1-4H.
What are the key properties of 3-bromo-8-chloro-1,5-naphthyridine?
3-bromo-8-chloro-1,5-naphthyridine has a molecular weight of 243.49 g/mol, XLogP of 3.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-8-chloro-1,5-naphthyridine is sourced from PubChem (CID 13459137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).