2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine

C80H48Cl4F4N24 — CID 158464061

IUPAC2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine
SMILESClc1ccccc1-c1nc(Nc2n[nH]c3ccccc23)c2ccncc2n1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1ccc2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1cccc2c(Nc3nc(-c4ccccc4Cl)nc4ncccc34)n[nH]c12
InChIInChI=1S/C20H11ClF2N6.2C20H12ClFN6.C20H13ClN6/c21-14-6-2-1-4-11(14)18-25-17-12(5-3-7-24-17)19(26-18)27-20-13-8-10(22)9-15(23)16(13)28-29-20;21-14-8-2-1-5-11(14)18-24-17-13(7-4-10-23-17)19(25-18)26-20-12-6-3-9-15(22)16(12)27-28-20;21-15-6-2-1-4-12(15)18-24-17-13(5-3-9-23-17)19(25-18)26-20-14-10-11(22)7-8-16(14)27-28-20;21-15-7-3-1-5-12(15)18-23-17-11-22-10-9-14(17)19(24-18)25-20-13-6-2-4-8-16(13)26-27-20/h1-9H,(H2,24,25,26,27,28,29);2*1-10H,(H2,23,24,25,26,27,28);1-11H,(H2,23,24,25,26,27)
InChIKeyHFNLWZVBPZFSBN-UHFFFAOYSA-N
MW1563.24 g/mol
LogP20.42
Rot. Bonds12

About 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine

2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine (PubChem CID 158464061) has the molecular formula C80H48Cl4F4N24 and a molecular weight of 1563.24 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine
PubChem CID158464061
Molecular FormulaC80H48Cl4F4N24
Molecular Weight1563.24 g/mol
Exact Mass1560.32
IUPAC Name2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine
SMILESClc1ccccc1-c1nc(Nc2n[nH]c3ccccc23)c2ccncc2n1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1ccc2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1cccc2c(Nc3nc(-c4ccccc4Cl)nc4ncccc34)n[nH]c12
InChIInChI=1S/C20H11ClF2N6.2C20H12ClFN6.C20H13ClN6/c21-14-6-2-1-4-11(14)18-25-17-12(5-3-7-24-17)19(26-18)27-20-13-8-10(22)9-15(23)16(13)28-29-20;21-14-8-2-1-5-11(14)18-24-17-13(7-4-10-23-17)19(25-18)26-20-12-6-3-9-15(22)16(12)27-28-20;21-15-6-2-1-4-12(15)18-24-17-13(5-3-9-23-17)19(25-18)26-20-14-10-11(22)7-8-16(14)27-28-20;21-15-7-3-1-5-12(15)18-23-17-11-22-10-9-14(17)19(24-18)25-20-13-6-2-4-8-16(13)26-27-20/h1-9H,(H2,24,25,26,27,28,29);2*1-10H,(H2,23,24,25,26,27,28);1-11H,(H2,23,24,25,26,27)
InChIKeyHFNLWZVBPZFSBN-UHFFFAOYSA-N
XLogP20.42
TPSA317.52 Ų
H-Bond Donors8
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms112
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001563.24
LogP ≤ 520.42
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1020

Analyze 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine (CID 158464061) is 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine is Clc1ccccc1-c1nc(Nc2n[nH]c3ccccc23)c2ccncc2n1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1ccc2[nH]nc(Nc3nc(-c4ccccc4Cl)nc4ncccc34)c2c1.Fc1cccc2c(Nc3nc(-c4ccccc4Cl)nc4ncccc34)n[nH]c12.
What is the InChIKey of 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is HFNLWZVBPZFSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11ClF2N6.2C20H12ClFN6.C20H13ClN6/c21-14-6-2-1-4-11(14)18-25-17-12(5-3-7-24-17)19(26-18)27-20-13-8-10(22)9-15(23)16(13)28-29-20;21-14-8-2-1-5-11(14)18-24-17-13(7-4-10-23-17)19(25-18)26-20-12-6-3-9-15(22)16(12)27-28-20;21-15-6-2-1-4-12(15)18-24-17-13(5-3-9-23-17)19(25-18)26-20-14-10-11(22)7-8-16(14)27-28-20;21-15-7-3-1-5-12(15)18-23-17-11-22-10-9-14(17)19(24-18)25-20-13-6-2-4-8-16(13)26-27-20/h1-9H,(H2,24,25,26,27,28,29);2*1-10H,(H2,23,24,25,26,27,28);1-11H,(H2,23,24,25,26,27).
What are the key properties of 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine?
2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 1563.24 g/mol, XLogP of 20.42, 12 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(5-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(7-fluoro-1H-indazol-3-yl)pyrido[2,3-d]pyrimidin-4-amine;2-(2-chlorophenyl)-N-(1H-indazol-3-yl)pyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 158464061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).