5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine

C10H6Br2N6 — CID 103098993

IUPAC5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine
SMILESNc1nc(Br)n(-c2ccnc3cc(Br)cnc23)n1
InChIInChI=1S/C10H6Br2N6/c11-5-3-6-8(15-4-5)7(1-2-14-6)18-9(12)16-10(13)17-18/h1-4H,(H2,13,17)
InChIKeyPYMURBCUSBNEKO-UHFFFAOYSA-N
MW370.01 g/mol
LogP2.32
Rot. Bonds1

About 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine

5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine (PubChem CID 103098993) has the molecular formula C10H6Br2N6 and a molecular weight of 370.01 g/mol. Its IUPAC name is 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine
PubChem CID103098993
Molecular FormulaC10H6Br2N6
Molecular Weight370.01 g/mol
Exact Mass367.90
IUPAC Name5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine
SMILESNc1nc(Br)n(-c2ccnc3cc(Br)cnc23)n1
InChIInChI=1S/C10H6Br2N6/c11-5-3-6-8(15-4-5)7(1-2-14-6)18-9(12)16-10(13)17-18/h1-4H,(H2,13,17)
InChIKeyPYMURBCUSBNEKO-UHFFFAOYSA-N
XLogP2.32
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.01
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-bromo-1-quinolin-4-yl-1,2,4-triazol-3-amine
CID 103099001
5-bromo-1-(5-bromo-3-chloro-2-pyridinyl)-1,2,4-triazol-3-amine
CID 103583004
3-bromo-8-chloro-1,5-naphthyridine
CID 13459137
3-bromo-8-(4-phenyl-1,4-diazepan-1-yl)-1,5-naphthyridine
CID 133482284
3-bromo-8-(4-pyridazin-3-ylpiperazin-1-yl)-1,5-naphthyridine
CID 133482708
3-bromo-8-[4-(thiophen-2-ylmethyl)piperazin-1-yl]-1,5-naphthyridine
CID 133481610
4-(7-bromo-1,5-naphthyridin-4-yl)-1,4-thiazepane
CID 113394491
5-bromo-1-pyridin-2-yl-1,2,4-triazol-3-amine
CID 103098897
3-bromo-8-(3,4-dimethylpiperazin-1-yl)-1,5-naphthyridine
CID 113394506
3-amino-1-(7-bromo-1,5-naphthyridin-4-yl)pyrrolidine-3-carboxylic acid
CID 107325271
1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol
CID 114680866
[4-(7-bromo-1,5-naphthyridin-4-yl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 133481833

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine?
The IUPAC name of 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine (CID 103098993) is 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine.
What is the SMILES notation for 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine?
The canonical SMILES for 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine is Nc1nc(Br)n(-c2ccnc3cc(Br)cnc23)n1.
What is the InChIKey of 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine?
The InChIKey is PYMURBCUSBNEKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2N6/c11-5-3-6-8(15-4-5)7(1-2-14-6)18-9(12)16-10(13)17-18/h1-4H,(H2,13,17).
What are the key properties of 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine?
5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine has a molecular weight of 370.01 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-(7-bromo-1,5-naphthyridin-4-yl)-1,2,4-triazol-3-amine is sourced from PubChem (CID 103098993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).