3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine

C30H26Cl2N6O2 — CID 170696320

IUPAC3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine
SMILESCOc1cc(-c2nccc(-c3cccc(-c4ccc(C5=NCCN5)c(OC)n4)c3Cl)c2Cl)ccc1C1=NCCN1
InChIInChI=1S/C30H26Cl2N6O2/c1-39-24-16-17(6-7-21(24)28-34-12-13-35-28)27-26(32)19(10-11-33-27)18-4-3-5-20(25(18)31)23-9-8-22(30(38-23)40-2)29-36-14-15-37-29/h3-11,16H,12-15H2,1-2H3,(H,34,35)(H,36,37)
InChIKeyWAWGYMFIJABLME-UHFFFAOYSA-N
MW573.48 g/mol
LogP5.50
Rot. Bonds7

About 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine

3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine (PubChem CID 170696320) has the molecular formula C30H26Cl2N6O2 and a molecular weight of 573.48 g/mol. Its IUPAC name is 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine.

Molecular Properties

Compound Name3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine
PubChem CID170696320
Molecular FormulaC30H26Cl2N6O2
Molecular Weight573.48 g/mol
Exact Mass572.15
IUPAC Name3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine
SMILESCOc1cc(-c2nccc(-c3cccc(-c4ccc(C5=NCCN5)c(OC)n4)c3Cl)c2Cl)ccc1C1=NCCN1
InChIInChI=1S/C30H26Cl2N6O2/c1-39-24-16-17(6-7-21(24)28-34-12-13-35-28)27-26(32)19(10-11-33-27)18-4-3-5-20(25(18)31)23-9-8-22(30(38-23)40-2)29-36-14-15-37-29/h3-11,16H,12-15H2,1-2H3,(H,34,35)(H,36,37)
InChIKeyWAWGYMFIJABLME-UHFFFAOYSA-N
XLogP5.50
TPSA93.02 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500573.48
LogP ≤ 55.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine with MolForge

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Related Compounds

3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine
CID 166071235
(5R)-5-[[[4-[3-chloro-4-[2-chloro-3-[6-methoxy-5-[[methyl-[[(2S)-5-oxopyrrolidin-2-yl]methyl]amino]methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-2-methoxyphenyl]methyl-methylamino]methyl]pyrrolidin-2-one
CID 170697192
6-[3-[3-chloro-2-(4-formyl-3-methoxyphenyl)-4-pyridinyl]-2-methoxyphenyl]-2-methoxypyridine-3-carbaldehyde
CID 175513044
6-[3-[3-chloro-2-(4-formyl-3-methoxyphenyl)-4-pyridinyl]-2-fluorophenyl]-2-methoxypyridine-3-carbaldehyde
CID 170983450
2-[[4-[3-chloro-4-[2-chloro-3-[6-methoxy-5-[[(5-oxo-6-azaspiro[3.4]octan-2-yl)amino]methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-2-methoxyphenyl]methylamino]-6-azaspiro[3.4]octan-5-one
CID 170696661
3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine
CID 165380558
2-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]-6-fluorophenyl]-6-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]benzonitrile
CID 146206628
6-[2-chloro-3-[2-chloro-3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methoxyphenyl]phenyl]phenyl]-2-methoxypyridine-3-carbaldehyde
CID 146207087
(4R)-4-[[[4-[3-chloro-4-[2-chloro-3-[6-methoxy-5-[[[(3R)-5-oxopyrrolidin-3-yl]methylamino]methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-2-methoxyphenyl]methylamino]methyl]pyrrolidin-2-one
CID 170697656
4-[[[4-[3-chloro-4-[2-chloro-3-[6-methoxy-5-[[(5-oxopyrrolidin-3-yl)methylamino]methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-2-methoxyphenyl]methylamino]methyl]pyrrolidin-2-one
CID 174186668
2-[[6-[2-chloro-3-[3-chloro-2-[3-methoxy-4-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)phenyl]-4-pyridinyl]phenyl]-2-methoxy-3-pyridinyl]methyl]-7-oxa-2-azaspiro[3.5]nonane
CID 170696468
1-[[4-[4-[2-chloro-3-[5-[(2-hydroxypropylamino)methyl]-6-methoxy-2-pyridinyl]phenyl]-3-methyl-2-pyridinyl]-2-methoxyphenyl]methylamino]propan-2-ol
CID 174186760

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine?
The IUPAC name of 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine (CID 170696320) is 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine.
What is the SMILES notation for 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine?
The canonical SMILES for 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine is COc1cc(-c2nccc(-c3cccc(-c4ccc(C5=NCCN5)c(OC)n4)c3Cl)c2Cl)ccc1C1=NCCN1.
What is the InChIKey of 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine?
The InChIKey is WAWGYMFIJABLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26Cl2N6O2/c1-39-24-16-17(6-7-21(24)28-34-12-13-35-28)27-26(32)19(10-11-33-27)18-4-3-5-20(25(18)31)23-9-8-22(30(38-23)40-2)29-36-14-15-37-29/h3-11,16H,12-15H2,1-2H3,(H,34,35)(H,36,37).
What are the key properties of 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine?
3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine has a molecular weight of 573.48 g/mol, XLogP of 5.50, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-[2-chloro-3-[5-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-pyridinyl]phenyl]-2-[4-(4,5-dihydro-1H-imidazol-2-yl)-3-methoxyphenyl]pyridine is sourced from PubChem (CID 170696320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).