N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine

C23H15BrN4OS — CID 87076613

IUPACN-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine
SMILESBrc1cnc(Nc2nc(-c3ccccc3)cs2)cc1Oc1cccc2ncccc12
InChIInChI=1S/C23H15BrN4OS/c24-17-13-26-22(28-23-27-19(14-30-23)15-6-2-1-3-7-15)12-21(17)29-20-10-4-9-18-16(20)8-5-11-25-18/h1-14H,(H,26,27,28)
InChIKeyUUAZRNRAWNKMGN-UHFFFAOYSA-N
MW475.37 g/mol
LogP7.05
Rot. Bonds5

About N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine

N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine (PubChem CID 87076613) has the molecular formula C23H15BrN4OS and a molecular weight of 475.37 g/mol. Its IUPAC name is N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine
PubChem CID87076613
Molecular FormulaC23H15BrN4OS
Molecular Weight475.37 g/mol
Exact Mass474.01
IUPAC NameN-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine
SMILESBrc1cnc(Nc2nc(-c3ccccc3)cs2)cc1Oc1cccc2ncccc12
InChIInChI=1S/C23H15BrN4OS/c24-17-13-26-22(28-23-27-19(14-30-23)15-6-2-1-3-7-15)12-21(17)29-20-10-4-9-18-16(20)8-5-11-25-18/h1-14H,(H,26,27,28)
InChIKeyUUAZRNRAWNKMGN-UHFFFAOYSA-N
XLogP7.05
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.37
LogP ≤ 57.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-1,3-thiazol-2-amine
CID 141187994
N-pyridin-2-yl-4-[4-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]phenyl]-1,3-thiazol-2-amine;N-pyridin-3-yl-4-[3-[2-(pyridin-3-ylamino)-1,3-thiazol-4-yl]phenyl]-1,3-thiazol-2-amine
CID 18428300
tert-butyl 4-[2-[[5-bromo-4-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]amino]-1,3-thiazol-4-yl]piperidine-1-carboxylate
CID 86640988
N-(6-phenyl-3-pyridinyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791761
4-(1H-pyrazol-4-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 42645487
N-(5-iodo-4-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 86076382
4-(3,4-dimethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 556017
N-(2-methoxyphenyl)-4-(4-phenylphenyl)-1,3-thiazol-2-amine
CID 2303545
2-bromo-4-quinolin-5-yloxybenzenecarboximidamide
CID 107279689
4-(4-fluorophenyl)-N-(3-phenoxyphenyl)-1,3-thiazol-2-amine
CID 58791434
N-(4-methyl-2-pyridinyl)-4-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 163269079
N-pyridin-2-yl-4-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
CID 122499786

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine (CID 87076613) is N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine is Brc1cnc(Nc2nc(-c3ccccc3)cs2)cc1Oc1cccc2ncccc12.
What is the InChIKey of N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is UUAZRNRAWNKMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15BrN4OS/c24-17-13-26-22(28-23-27-19(14-30-23)15-6-2-1-3-7-15)12-21(17)29-20-10-4-9-18-16(20)8-5-11-25-18/h1-14H,(H,26,27,28).
What are the key properties of N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine?
N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 475.37 g/mol, XLogP of 7.05, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-quinolin-5-yloxy-2-pyridinyl)-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 87076613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).