2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine

C23H17ClFN7 — CID 146662225

IUPAC2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine
SMILESFc1ccc(Cl)cc1-c1nc[nH]c1-c1ccc2ncc(-c3cnc4n3CCNC4)cc2n1
InChIInChI=1S/C23H17ClFN7/c24-14-1-2-16(25)15(8-14)22-23(30-12-29-22)18-4-3-17-19(31-18)7-13(9-27-17)20-10-28-21-11-26-5-6-32(20)21/h1-4,7-10,12,26H,5-6,11H2,(H,29,30)
InChIKeyPEROWJPWWOXVRF-UHFFFAOYSA-N
MW445.89 g/mol
LogP4.45
Rot. Bonds3

About 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine

2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine (PubChem CID 146662225) has the molecular formula C23H17ClFN7 and a molecular weight of 445.89 g/mol. Its IUPAC name is 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine.

Molecular Properties

Compound Name2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine
PubChem CID146662225
Molecular FormulaC23H17ClFN7
Molecular Weight445.89 g/mol
Exact Mass445.12
IUPAC Name2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine
SMILESFc1ccc(Cl)cc1-c1nc[nH]c1-c1ccc2ncc(-c3cnc4n3CCNC4)cc2n1
InChIInChI=1S/C23H17ClFN7/c24-14-1-2-16(25)15(8-14)22-23(30-12-29-22)18-4-3-17-19(31-18)7-13(9-27-17)20-10-28-21-11-26-5-6-32(20)21/h1-4,7-10,12,26H,5-6,11H2,(H,29,30)
InChIKeyPEROWJPWWOXVRF-UHFFFAOYSA-N
XLogP4.45
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.89
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine?
The IUPAC name of 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine (CID 146662225) is 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine.
What is the SMILES notation for 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine?
The canonical SMILES for 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine is Fc1ccc(Cl)cc1-c1nc[nH]c1-c1ccc2ncc(-c3cnc4n3CCNC4)cc2n1.
What is the InChIKey of 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine?
The InChIKey is PEROWJPWWOXVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClFN7/c24-14-1-2-16(25)15(8-14)22-23(30-12-29-22)18-4-3-17-19(31-18)7-13(9-27-17)20-10-28-21-11-26-5-6-32(20)21/h1-4,7-10,12,26H,5-6,11H2,(H,29,30).
What are the key properties of 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine?
2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine has a molecular weight of 445.89 g/mol, XLogP of 4.45, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-chloro-2-fluorophenyl)-1H-imidazol-5-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,5-naphthyridine is sourced from PubChem (CID 146662225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).