8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C35H25Cl2N9O — CID 67366270

IUPAC8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1cc(N(c2nc3c(-c4ccc(Cl)cc4)cccn3n2)c2nc3c(-c4ccc(Cl)cc4)cccn3n2)ccc1-n1cnc(C)c1
InChIInChI=1S/C35H25Cl2N9O/c1-22-20-43(21-38-22)30-16-15-27(19-31(30)47-2)46(34-39-32-28(5-3-17-44(32)41-34)23-7-11-25(36)12-8-23)35-40-33-29(6-4-18-45(33)42-35)24-9-13-26(37)14-10-24/h3-21H,1-2H3
InChIKeyODQIEEZBDQFNQJ-UHFFFAOYSA-N
MW658.55 g/mol
LogP8.39
Rot. Bonds7

About 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 67366270) has the molecular formula C35H25Cl2N9O and a molecular weight of 658.55 g/mol. Its IUPAC name is 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID67366270
Molecular FormulaC35H25Cl2N9O
Molecular Weight658.55 g/mol
Exact Mass657.16
IUPAC Name8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1cc(N(c2nc3c(-c4ccc(Cl)cc4)cccn3n2)c2nc3c(-c4ccc(Cl)cc4)cccn3n2)ccc1-n1cnc(C)c1
InChIInChI=1S/C35H25Cl2N9O/c1-22-20-43(21-38-22)30-16-15-27(19-31(30)47-2)46(34-39-32-28(5-3-17-44(32)41-34)23-7-11-25(36)12-8-23)35-40-33-29(6-4-18-45(33)42-35)24-9-13-26(37)14-10-24/h3-21H,1-2H3
InChIKeyODQIEEZBDQFNQJ-UHFFFAOYSA-N
XLogP8.39
TPSA90.67 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500658.55
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine with MolForge

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Related Compounds

2-[8-(4-chlorophenyl)-2-[3-methoxy-4-(4-methylimidazol-1-yl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]propan-2-ol
CID 53340234
2-[(4-chlorophenyl)methyl]-4-methoxy-6-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methyl]-1,3,5-triazine
CID 161459860
4-(4-chlorophenyl)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-1,3-thiazol-2-amine
CID 86624674
8-(4-fluoropiperidin-1-yl)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 53340581
8-(3,4-difluorophenyl)-6-fluoro-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 53339677
3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[(1R)-1-(3,4,5-trifluorophenyl)ethyl]pyrazolo[3,4-b]pyridine
CID 42635283
azane;1-[4-(4H-imidazol-2-yl)-2-methoxyphenyl]-4-methylimidazole
CID 158028310
8-(4-fluorophenyl)-2-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methyl]-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 58375643
3-methoxy-4-(4-methylimidazol-1-yl)benzenesulfonyl chloride
CID 59591064
6-(5-chloro-2-methylphenyl)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3H-isoindol-1-one
CID 67809329
2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-4,5-dimethyl-1H-imidazole
CID 66857127
3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-5-methyl-1H-1,2,4-triazole
CID 67797926

Frequently Asked Questions

What is the IUPAC name of 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 67366270) is 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is COc1cc(N(c2nc3c(-c4ccc(Cl)cc4)cccn3n2)c2nc3c(-c4ccc(Cl)cc4)cccn3n2)ccc1-n1cnc(C)c1.
What is the InChIKey of 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is ODQIEEZBDQFNQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H25Cl2N9O/c1-22-20-43(21-38-22)30-16-15-27(19-31(30)47-2)46(34-39-32-28(5-3-17-44(32)41-34)23-7-11-25(36)12-8-23)35-40-33-29(6-4-18-45(33)42-35)24-9-13-26(37)14-10-24/h3-21H,1-2H3.
What are the key properties of 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 658.55 g/mol, XLogP of 8.39, 7 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-chlorophenyl)-N-[8-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 67366270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).