N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine

C24H20BrN5S — CID 15965568

IUPACN-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine
SMILESCc1ccc(-c2nc3ccc(C)cn3c2Cc2nnc(Nc3ccc(Br)cc3)s2)cc1
InChIInChI=1S/C24H20BrN5S/c1-15-3-6-17(7-4-15)23-20(30-14-16(2)5-12-21(30)27-23)13-22-28-29-24(31-22)26-19-10-8-18(25)9-11-19/h3-12,14H,13H2,1-2H3,(H,26,29)
InChIKeyWDFMZMMGGRNVGR-UHFFFAOYSA-N
MW490.43 g/mol
LogP6.57
Rot. Bonds5

About N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine

N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine (PubChem CID 15965568) has the molecular formula C24H20BrN5S and a molecular weight of 490.43 g/mol. Its IUPAC name is N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine
PubChem CID15965568
Molecular FormulaC24H20BrN5S
Molecular Weight490.43 g/mol
Exact Mass489.06
IUPAC NameN-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine
SMILESCc1ccc(-c2nc3ccc(C)cn3c2Cc2nnc(Nc3ccc(Br)cc3)s2)cc1
InChIInChI=1S/C24H20BrN5S/c1-15-3-6-17(7-4-15)23-20(30-14-16(2)5-12-21(30)27-23)13-22-28-29-24(31-22)26-19-10-8-18(25)9-11-19/h3-12,14H,13H2,1-2H3,(H,26,29)
InChIKeyWDFMZMMGGRNVGR-UHFFFAOYSA-N
XLogP6.57
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.43
LogP ≤ 56.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine 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

N-methyl-1-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 70326815
[2-(4-bromophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine;oxalic acid
CID 2757136
2-[6-bromo-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82030121
ethane;2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 143742261
3-(chloromethyl)-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridine;[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanol;hydrochloride
CID 162000002
3-(chloromethyl)-2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridine;hydrochloride
CID 67028789
6-bromo-2-(4-methoxyphenyl)-N-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 7338761
3-butyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 143046958
3-(chloromethyl)-6-methyl-2-pyridin-4-ylimidazo[1,2-a]pyridine
CID 39133014
2-[3-(4-bromoanilino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
CID 118796411
2-[2-(4-bromoanilino)-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
CID 2175811
3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 165178013

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine (CID 15965568) is N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine is Cc1ccc(-c2nc3ccc(C)cn3c2Cc2nnc(Nc3ccc(Br)cc3)s2)cc1.
What is the InChIKey of N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine?
The InChIKey is WDFMZMMGGRNVGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20BrN5S/c1-15-3-6-17(7-4-15)23-20(30-14-16(2)5-12-21(30)27-23)13-22-28-29-24(31-22)26-19-10-8-18(25)9-11-19/h3-12,14H,13H2,1-2H3,(H,26,29).
What are the key properties of N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine?
N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine has a molecular weight of 490.43 g/mol, XLogP of 6.57, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-5-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 15965568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).