(6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

C72H54BrCl5N16O9S3 — CID 157284201

About (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

(6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde (PubChem CID 157284201) has the molecular formula C72H54BrCl5N16O9S3 and a molecular weight of 1640.70 g/mol. Its IUPAC name is (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde.

Molecular Properties

• Compound Name: (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
• PubChem CID: 157284201
• Molecular Formula: C72H54BrCl5N16O9S3
• Molecular Weight: 1640.70 g/mol
• Exact Mass: 1636.10
• IUPAC Name: (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
• SMILES: Clc1cnc2[nH]ccc2c1.Nc1ccc(Br)cn1.Nc1ccc(C(O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Cl)cc23)cn1.Nc1ccc(Cc2cn(S(=O)(=O)c3ccccc3)c3ncc(Cl)cc23)cn1.O=Cc1c[nH]c2ncc(Cl)cc12.O=Cc1cn(S(=O)(=O)c2ccccc2)c2ncc(Cl)cc12
• InChI: InChI=1S/C19H15ClN4O3S.C19H15ClN4O2S.C14H9ClN2O3S.C8H5ClN2O.C7H5ClN2.C5H5BrN2/c20-13-8-15-16(18(25)12-6-7-17(21)22-9-12)11-24(19(15)23-10-13)28(26,27)14-4-2-1-3-5-14;20-15-9-17-14(8-13-6-7-18(21)22-10-13)12-24(19(17)23-11-15)27(25,26)16-4-2-1-3-5-16;15-11-6-13-10(9-18)8-17(14(13)16-7-11)21(19,20)12-4-2-1-3-5-12;9-6-1-7-5(4-12)2-10-8(7)11-3-6;8-6-3-5-1-2-9-7(5)10-4-6;6-4-1-2-5(7)8-3-4/h1-11,18,25H,(H2,21,22);1-7,9-12H,8H2,(H2,21,22);1-9H;1-4H,(H,10,11);1-4H,(H,9,10);1-3H,(H2,7,8)
• InChIKey: BAALYFHXOMHFGK-UHFFFAOYSA-N
• XLogP: 14.89
• TPSA: 384.34 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 12
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1640.70
LogP ≤ 5	14.89
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde?

The IUPAC name of (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde (CID 157284201) is (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde.

What is the SMILES notation for (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde?

The canonical SMILES for (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde is Clc1cnc2[nH]ccc2c1.Nc1ccc(Br)cn1.Nc1ccc(C(O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Cl)cc23)cn1.Nc1ccc(Cc2cn(S(=O)(=O)c3ccccc3)c3ncc(Cl)cc23)cn1.O=Cc1c[nH]c2ncc(Cl)cc12.O=Cc1cn(S(=O)(=O)c2ccccc2)c2ncc(Cl)cc12.

What is the InChIKey of (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde?

The InChIKey is BAALYFHXOMHFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4O3S.C19H15ClN4O2S.C14H9ClN2O3S.C8H5ClN2O.C7H5ClN2.C5H5BrN2/c20-13-8-15-16(18(25)12-6-7-17(21)22-9-12)11-24(19(15)23-10-13)28(26,27)14-4-2-1-3-5-14;20-15-9-17-14(8-13-6-7-18(21)22-10-13)12-24(19(17)23-11-15)27(25,26)16-4-2-1-3-5-16;15-11-6-13-10(9-18)8-17(14(13)16-7-11)21(19,20)12-4-2-1-3-5-12;9-6-1-7-5(4-12)2-10-8(7)11-3-6;8-6-3-5-1-2-9-7(5)10-4-6;6-4-1-2-5(7)8-3-4/h1-11,18,25H,(H2,21,22);1-7,9-12H,8H2,(H2,21,22);1-9H;1-4H,(H,10,11);1-4H,(H,9,10);1-3H,(H2,7,8).

What are the key properties of (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde?

(6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde has a molecular weight of 1640.70 g/mol, XLogP of 14.89, 12 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for (6-amino-3-pyridinyl)-[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methanol;1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridine-3-carbaldehyde;5-[[1-(benzenesulfonyl)-5-chloropyrrolo[2,3-b]pyridin-3-yl]methyl]pyridin-2-amine;5-bromopyridin-2-amine;5-chloro-1H-pyrrolo[2,3-b]pyridine;5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde is sourced from PubChem (CID 157284201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).