2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine

C28H22Cl2N6 — CID 146206798

IUPAC2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine
SMILESClc1c(-c2ccc(C3=NCCN3)cn2)cccc1-c1cccc(-c2ccc(C3=NCCN3)cn2)c1Cl
InChIInChI=1S/C28H22Cl2N6/c29-25-19(3-1-5-21(25)23-9-7-17(15-35-23)27-31-11-12-32-27)20-4-2-6-22(26(20)30)24-10-8-18(16-36-24)28-33-13-14-34-28/h1-10,15-16H,11-14H2,(H,31,32)(H,33,34)
InChIKeyFGEDYEUUQJEFPN-UHFFFAOYSA-N
MW513.43 g/mol
LogP5.48
Rot. Bonds5

About 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine

2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine (PubChem CID 146206798) has the molecular formula C28H22Cl2N6 and a molecular weight of 513.43 g/mol. Its IUPAC name is 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine.

Molecular Properties

Compound Name2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine
PubChem CID146206798
Molecular FormulaC28H22Cl2N6
Molecular Weight513.43 g/mol
Exact Mass512.13
IUPAC Name2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine
SMILESClc1c(-c2ccc(C3=NCCN3)cn2)cccc1-c1cccc(-c2ccc(C3=NCCN3)cn2)c1Cl
InChIInChI=1S/C28H22Cl2N6/c29-25-19(3-1-5-21(25)23-9-7-17(15-35-23)27-31-11-12-32-27)20-4-2-6-22(26(20)30)24-10-8-18(16-36-24)28-33-13-14-34-28/h1-10,15-16H,11-14H2,(H,31,32)(H,33,34)
InChIKeyFGEDYEUUQJEFPN-UHFFFAOYSA-N
XLogP5.48
TPSA74.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.43
LogP ≤ 55.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine?
The IUPAC name of 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine (CID 146206798) is 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine.
What is the SMILES notation for 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine?
The canonical SMILES for 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine is Clc1c(-c2ccc(C3=NCCN3)cn2)cccc1-c1cccc(-c2ccc(C3=NCCN3)cn2)c1Cl.
What is the InChIKey of 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine?
The InChIKey is FGEDYEUUQJEFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22Cl2N6/c29-25-19(3-1-5-21(25)23-9-7-17(15-35-23)27-31-11-12-32-27)20-4-2-6-22(26(20)30)24-10-8-18(16-36-24)28-33-13-14-34-28/h1-10,15-16H,11-14H2,(H,31,32)(H,33,34).
What are the key properties of 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine?
2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine has a molecular weight of 513.43 g/mol, XLogP of 5.48, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-3-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinyl]phenyl]phenyl]-5-(4,5-dihydro-1H-imidazol-2-yl)pyridine is sourced from PubChem (CID 146206798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).