N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine

C91H56F2N26O2S6 — CID 165062702

About N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine

N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine (PubChem CID 165062702) has the molecular formula C91H56F2N26O2S6 and a molecular weight of 1776.03 g/mol. Its IUPAC name is N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine.

Molecular Properties

• Compound Name: N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine
• PubChem CID: 165062702
• Molecular Formula: C91H56F2N26O2S6
• Molecular Weight: 1776.03 g/mol
• Exact Mass: 1774.34
• IUPAC Name: N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine
• SMILES: Fc1cc(Nc2nc(-c3cncs3)nc3ccccc23)cc2cc[nH]c12.Fc1cc(Nc2nc(-c3cncs3)nc3ncccc23)cc2cc[nH]c12.c1ccc2c(Nc3ccc4cnoc4c3)nc(-c3cncs3)nc2c1.c1ccc2c(Nc3ccc4oncc4c3)nc(-c3cncs3)nc2c1.c1ccc2c(Nc3ccc4sncc4c3)nc(-c3cncs3)nc2c1
• InChI: InChI=1S/C19H12FN5S.C18H11FN6S.2C18H11N5OS.C18H11N5S2/c20-14-8-12(7-11-5-6-22-17(11)14)23-18-13-3-1-2-4-15(13)24-19(25-18)16-9-21-10-26-16;19-13-7-11(6-10-3-5-21-15(10)13)23-17-12-2-1-4-22-16(12)24-18(25-17)14-8-20-9-26-14;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-25-16)21-12-5-6-15-11(7-12)8-20-24-15;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-25-16)21-12-6-5-11-8-20-24-15(11)7-12;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-24-16)21-12-5-6-15-11(7-12)8-20-25-15/h1-10,22H,(H,23,24,25);1-9,21H,(H,22,23,24,25);3*1-10H,(H,21,22,23)
• InChIKey: RLQALKPHOTWTLD-UHFFFAOYSA-N
• XLogP: 24.01
• TPSA: 362.92 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 32
• Rotatable Bonds: 15
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1776.03
LogP ≤ 5	24.01
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine?

The IUPAC name of N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine (CID 165062702) is N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine.

What is the SMILES notation for N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine?

The canonical SMILES for N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine is Fc1cc(Nc2nc(-c3cncs3)nc3ccccc23)cc2cc[nH]c12.Fc1cc(Nc2nc(-c3cncs3)nc3ncccc23)cc2cc[nH]c12.c1ccc2c(Nc3ccc4cnoc4c3)nc(-c3cncs3)nc2c1.c1ccc2c(Nc3ccc4oncc4c3)nc(-c3cncs3)nc2c1.c1ccc2c(Nc3ccc4sncc4c3)nc(-c3cncs3)nc2c1.

What is the InChIKey of N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine?

The InChIKey is RLQALKPHOTWTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN5S.C18H11FN6S.2C18H11N5OS.C18H11N5S2/c20-14-8-12(7-11-5-6-22-17(11)14)23-18-13-3-1-2-4-15(13)24-19(25-18)16-9-21-10-26-16;19-13-7-11(6-10-3-5-21-15(10)13)23-17-12-2-1-4-22-16(12)24-18(25-17)14-8-20-9-26-14;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-25-16)21-12-5-6-15-11(7-12)8-20-24-15;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-25-16)21-12-6-5-11-8-20-24-15(11)7-12;1-2-4-14-13(3-1)17(23-18(22-14)16-9-19-10-24-16)21-12-5-6-15-11(7-12)8-20-25-15/h1-10,22H,(H,23,24,25);1-9,21H,(H,22,23,24,25);3*1-10H,(H,21,22,23).

What are the key properties of N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine?

N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine has a molecular weight of 1776.03 g/mol, XLogP of 24.01, 15 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)pyrido[2,3-d]pyrimidin-4-amine;N-(7-fluoro-1H-indol-5-yl)-2-(1,3-thiazol-5-yl)quinazolin-4-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzothiazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-5-amine;N-[2-(1,3-thiazol-5-yl)quinazolin-4-yl]-1,2-benzoxazol-6-amine is sourced from PubChem (CID 165062702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).