7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine

C73H43Br5Cl11N23O6S4 — CID 158259574

About 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine

7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine (PubChem CID 158259574) has the molecular formula C73H43Br5Cl11N23O6S4 and a molecular weight of 2256.07 g/mol. Its IUPAC name is 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine.

Molecular Properties

• Compound Name: 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine
• PubChem CID: 158259574
• Molecular Formula: C73H43Br5Cl11N23O6S4
• Molecular Weight: 2256.07 g/mol
• Exact Mass: 2244.51
• IUPAC Name: 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine
• SMILES: Clc1nc(Cl)c2cc(Br)[nH]c2n1.Clc1nc(Cl)c2cc[nH]c2n1.Cn1c(Br)cc2c(C(=O)c3cccs3)nc(Cl)nc21.Cn1c(Br)cc2c(C(=O)c3cccs3)nc(NCc3cccnc3)nc21.Cn1c(Br)cc2c(Cl)nc(Cl)nc21.O=S(=O)(c1ccccc1)n1c(Br)cc2c(Cl)nc(Cl)nc21.O=S(=O)(c1ccccc1)n1ccc2c(Cl)nc(Cl)nc21
• InChI: InChI=1S/C18H14BrN5OS.C12H6BrCl2N3O2S.C12H7BrClN3OS.C12H7Cl2N3O2S.C7H4BrCl2N3.C6H2BrCl2N3.C6H3Cl2N3/c1-24-14(19)8-12-15(16(25)13-5-3-7-26-13)22-18(23-17(12)24)21-10-11-4-2-6-20-9-11;13-9-6-8-10(14)16-12(15)17-11(8)18(9)21(19,20)7-4-2-1-3-5-7;1-17-8(13)5-6-9(15-12(14)16-11(6)17)10(18)7-3-2-4-19-7;13-10-9-6-7-17(11(9)16-12(14)15-10)20(18,19)8-4-2-1-3-5-8;1-13-4(8)2-3-5(9)11-7(10)12-6(3)13;7-3-1-2-4(8)11-6(9)12-5(2)10-3;7-4-3-1-2-9-5(3)11-6(8)10-4/h2-9H,10H2,1H3,(H,21,22,23);1-6H;2-5H,1H3;1-7H;2H,1H3;1H,(H,10,11,12);1-2H,(H,9,10,11)
• InChIKey: GHSFGSYWAODZNL-UHFFFAOYSA-N
• XLogP: 22.75
• TPSA: 364.03 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 29
• Rotatable Bonds: 11
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2256.07
LogP ≤ 5	22.75
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine?

The IUPAC name of 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine (CID 158259574) is 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine.

What is the SMILES notation for 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine?

The canonical SMILES for 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine is Clc1nc(Cl)c2cc(Br)[nH]c2n1.Clc1nc(Cl)c2cc[nH]c2n1.Cn1c(Br)cc2c(C(=O)c3cccs3)nc(Cl)nc21.Cn1c(Br)cc2c(C(=O)c3cccs3)nc(NCc3cccnc3)nc21.Cn1c(Br)cc2c(Cl)nc(Cl)nc21.O=S(=O)(c1ccccc1)n1c(Br)cc2c(Cl)nc(Cl)nc21.O=S(=O)(c1ccccc1)n1ccc2c(Cl)nc(Cl)nc21.

What is the InChIKey of 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine?

The InChIKey is GHSFGSYWAODZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrN5OS.C12H6BrCl2N3O2S.C12H7BrClN3OS.C12H7Cl2N3O2S.C7H4BrCl2N3.C6H2BrCl2N3.C6H3Cl2N3/c1-24-14(19)8-12-15(16(25)13-5-3-7-26-13)22-18(23-17(12)24)21-10-11-4-2-6-20-9-11;13-9-6-8-10(14)16-12(15)17-11(8)18(9)21(19,20)7-4-2-1-3-5-7;1-17-8(13)5-6-9(15-12(14)16-11(6)17)10(18)7-3-2-4-19-7;13-10-9-6-7-17(11(9)16-12(14)15-10)20(18,19)8-4-2-1-3-5-8;1-13-4(8)2-3-5(9)11-7(10)12-6(3)13;7-3-1-2-4(8)11-6(9)12-5(2)10-3;7-4-3-1-2-9-5(3)11-6(8)10-4/h2-9H,10H2,1H3,(H,21,22,23);1-6H;2-5H,1H3;1-7H;2H,1H3;1H,(H,10,11,12);1-2H,(H,9,10,11).

What are the key properties of 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine?

7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine has a molecular weight of 2256.07 g/mol, XLogP of 22.75, 11 rotatable bonds, 3 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(benzenesulfonyl)-6-bromo-2,4-dichloropyrrolo[2,3-d]pyrimidine;7-(benzenesulfonyl)-2,4-dichloropyrrolo[2,3-d]pyrimidine;(6-bromo-2-chloro-7-methylpyrrolo[2,3-d]pyrimidin-4-yl)-thiophen-2-ylmethanone;6-bromo-2,4-dichloro-7-methylpyrrolo[2,3-d]pyrimidine;6-bromo-2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine;[6-bromo-7-methyl-2-(pyridin-3-ylmethylamino)pyrrolo[2,3-d]pyrimidin-4-yl]-thiophen-2-ylmethanone;2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine is sourced from PubChem (CID 158259574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).