2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine

C24H16BrNO — CID 22333272

IUPAC2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)c3c(n2)-c2ccccc2OC3)cc1
InChIInChI=1S/C24H16BrNO/c25-18-12-10-17(11-13-18)22-14-20(16-6-2-1-3-7-16)21-15-27-23-9-5-4-8-19(23)24(21)26-22/h1-14H,15H2
InChIKeyFGCPIGZHKXFXGW-UHFFFAOYSA-N
MW414.30 g/mol
LogP6.74
Rot. Bonds2

About 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine

2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine (PubChem CID 22333272) has the molecular formula C24H16BrNO and a molecular weight of 414.30 g/mol. Its IUPAC name is 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine.

Molecular Properties

Compound Name2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine
PubChem CID22333272
Molecular FormulaC24H16BrNO
Molecular Weight414.30 g/mol
Exact Mass413.04
IUPAC Name2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine
SMILESBrc1ccc(-c2cc(-c3ccccc3)c3c(n2)-c2ccccc2OC3)cc1
InChIInChI=1S/C24H16BrNO/c25-18-12-10-17(11-13-18)22-14-20(16-6-2-1-3-7-16)21-15-27-23-9-5-4-8-19(23)24(21)26-22/h1-14H,15H2
InChIKeyFGCPIGZHKXFXGW-UHFFFAOYSA-N
XLogP6.74
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.30
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-bromophenyl)-4-(4-methylphenyl)-5H-chromeno[4,3-b]pyridine
CID 22333276
2,4-diphenyl-5H-chromeno[4,3-b]pyridine
CID 5096779
2-phenyl-4-pyridin-3-yl-5H-chromeno[4,3-b]pyridine
CID 53375672
3-[2-(4-hydroxyphenyl)-5H-chromeno[4,3-b]pyridin-4-yl]phenol
CID 137133397
9-fluoro-4-(4-methylphenyl)-2-phenyl-5H-chromeno[4,3-b]pyridine
CID 22333303
2-[2-(3-hydroxyphenyl)-5H-chromeno[4,3-b]pyridin-4-yl]phenol
CID 137133390
4-(4-bromophenyl)-2-phenyl-5,6-dihydrobenzo[j][1,7]phenanthroline
CID 134689882
2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine
CID 53361435
2-[4-(6H-benzo[c]chromen-10-yl)phenyl]-4-(2-phenylphenyl)-6-(4-phenylphenyl)pyridine
CID 169281865
2-(4-bromophenyl)-4,6-diphenyl-1,3,5-triazine;4-(4-bromophenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 154929027
4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline
CID 3736312
13-phenyl-10-oxa-2-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4,6,8,13,15,17,19,21-decaene
CID 164671603

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine?
The IUPAC name of 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine (CID 22333272) is 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine.
What is the SMILES notation for 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine?
The canonical SMILES for 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine is Brc1ccc(-c2cc(-c3ccccc3)c3c(n2)-c2ccccc2OC3)cc1.
What is the InChIKey of 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine?
The InChIKey is FGCPIGZHKXFXGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16BrNO/c25-18-12-10-17(11-13-18)22-14-20(16-6-2-1-3-7-16)21-15-27-23-9-5-4-8-19(23)24(21)26-22/h1-14H,15H2.
What are the key properties of 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine?
2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine has a molecular weight of 414.30 g/mol, XLogP of 6.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine is sourced from PubChem (CID 22333272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).