N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide

C124H100N28O4S4 — CID 158254218

About N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide

N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide (PubChem CID 158254218) has the molecular formula C124H100N28O4S4 and a molecular weight of 2174.62 g/mol. Its IUPAC name is N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide.

Molecular Properties

• Compound Name: N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide
• PubChem CID: 158254218
• Molecular Formula: C124H100N28O4S4
• Molecular Weight: 2174.62 g/mol
• Exact Mass: 2172.74
• IUPAC Name: N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide
• SMILES: Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4c(N5Cc6ccccc6C5)cccn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4cc(N5Cc6ccccc6C5)ccn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4ccc(N5Cc6ccccc6C5)cn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4cccc(N5Cc6ccccc6C5)n34)s2)cc1
• InChI: InChI=1S/4C31H25N7OS/c32-24-8-3-4-9-25(24)36-30(39)20-11-13-23(14-12-20)35-31-34-17-28(40-31)27-16-33-29-26(10-5-15-38(27)29)37-18-21-6-1-2-7-22(21)19-37;32-24-8-3-4-9-25(24)36-30(39)20-12-14-23(15-13-20)35-31-34-17-27(40-31)26-16-33-28-10-5-11-29(38(26)28)37-18-21-6-1-2-7-22(21)19-37;32-25-7-3-4-8-26(25)36-30(39)20-9-11-23(12-10-20)35-31-34-17-28(40-31)27-16-33-29-15-24(13-14-38(27)29)37-18-21-5-1-2-6-22(21)19-37;32-25-7-3-4-8-26(25)36-30(39)20-9-11-23(12-10-20)35-31-34-16-28(40-31)27-15-33-29-14-13-24(19-38(27)29)37-17-21-5-1-2-6-22(21)18-37/h3*1-17H,18-19,32H2,(H,34,35)(H,36,39);1-16,19H,17-18,32H2,(H,34,35)(H,36,39)
• InChIKey: GHBRLZQYFZNDCS-UHFFFAOYSA-N
• XLogP: 26.22
• TPSA: 402.32 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 32
• Rotatable Bonds: 24
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2174.62
LogP ≤ 5	26.22
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide?

The IUPAC name of N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide (CID 158254218) is N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide.

What is the SMILES notation for N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide?

The canonical SMILES for N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide is Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4c(N5Cc6ccccc6C5)cccn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4cc(N5Cc6ccccc6C5)ccn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4ccc(N5Cc6ccccc6C5)cn34)s2)cc1.Nc1ccccc1NC(=O)c1ccc(Nc2ncc(-c3cnc4cccc(N5Cc6ccccc6C5)n34)s2)cc1.

What is the InChIKey of N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide?

The InChIKey is GHBRLZQYFZNDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/4C31H25N7OS/c32-24-8-3-4-9-25(24)36-30(39)20-11-13-23(14-12-20)35-31-34-17-28(40-31)27-16-33-29-26(10-5-15-38(27)29)37-18-21-6-1-2-7-22(21)19-37;32-24-8-3-4-9-25(24)36-30(39)20-12-14-23(15-13-20)35-31-34-17-27(40-31)26-16-33-28-10-5-11-29(38(26)28)37-18-21-6-1-2-7-22(21)19-37;32-25-7-3-4-8-26(25)36-30(39)20-9-11-23(12-10-20)35-31-34-17-28(40-31)27-16-33-29-15-24(13-14-38(27)29)37-18-21-5-1-2-6-22(21)19-37;32-25-7-3-4-8-26(25)36-30(39)20-9-11-23(12-10-20)35-31-34-16-28(40-31)27-15-33-29-14-13-24(19-38(27)29)37-17-21-5-1-2-6-22(21)18-37/h3*1-17H,18-19,32H2,(H,34,35)(H,36,39);1-16,19H,17-18,32H2,(H,34,35)(H,36,39).

What are the key properties of N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide?

N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide has a molecular weight of 2174.62 g/mol, XLogP of 26.22, 24 rotatable bonds, 12 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminophenyl)-4-[[5-[5-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[6-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[7-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide;N-(2-aminophenyl)-4-[[5-[8-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-yl]amino]benzamide is sourced from PubChem (CID 158254218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).