4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride

C59H44Cl5F14N11O9S2 — CID 157446866

About 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride

4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride (PubChem CID 157446866) has the molecular formula C59H44Cl5F14N11O9S2 and a molecular weight of 1558.44 g/mol. Its IUPAC name is 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride.

Molecular Properties

• Compound Name: 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride
• PubChem CID: 157446866
• Molecular Formula: C59H44Cl5F14N11O9S2
• Molecular Weight: 1558.44 g/mol
• Exact Mass: 1555.10
• IUPAC Name: 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride
• SMILES: C[C@@H]1N[C@H](C(=O)CCc2cc(-c3cnc(C(F)(F)F)nc3)ncc2C(F)(F)F)C[C@H]1F.C[C@H]1[C@H](F)C[C@@H](C(=O)CCc2cc(-c3cnc(C(F)(F)F)nc3)ncc2C(F)(F)F)N1S(=O)(=O)c1cc2c(Cl)nccc2o1.Cl.Clc1nccc2occc12.O=S(=O)(Cl)c1cc2c(Cl)nccc2o1
• InChI: InChI=1S/C26H19ClF7N5O4S.C19H17F7N4O.C7H3Cl2NO3S.C7H4ClNO.ClH/c1-12-17(28)8-19(39(12)44(41,42)22-7-15-21(43-22)4-5-35-23(15)27)20(40)3-2-13-6-18(36-11-16(13)25(29,30)31)14-9-37-24(38-10-14)26(32,33)34;1-9-13(20)5-15(30-9)16(31)3-2-10-4-14(27-8-12(10)18(21,22)23)11-6-28-17(29-7-11)19(24,25)26;8-7-4-3-6(14(9,11)12)13-5(4)1-2-10-7;8-7-5-2-4-10-6(5)1-3-9-7;/h4-7,9-12,17,19H,2-3,8H2,1H3;4,6-9,13,15,30H,2-3,5H2,1H3;1-3H;1-4H;1H/t12-,17+,19-;9-,13+,15-;;;/m00.../s1
• InChIKey: WIWNPWOYHHJHEN-WFXQPYFDSA-N
• XLogP: 15.54
• TPSA: 273.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 13
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1558.44
LogP ≤ 5	15.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride?

The IUPAC name of 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride (CID 157446866) is 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride.

What is the SMILES notation for 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride?

The canonical SMILES for 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride is C[C@@H]1N[C@H](C(=O)CCc2cc(-c3cnc(C(F)(F)F)nc3)ncc2C(F)(F)F)C[C@H]1F.C[C@H]1[C@H](F)C[C@@H](C(=O)CCc2cc(-c3cnc(C(F)(F)F)nc3)ncc2C(F)(F)F)N1S(=O)(=O)c1cc2c(Cl)nccc2o1.Cl.Clc1nccc2occc12.O=S(=O)(Cl)c1cc2c(Cl)nccc2o1.

What is the InChIKey of 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride?

The InChIKey is WIWNPWOYHHJHEN-WFXQPYFDSA-N. The full InChI is InChI=1S/C26H19ClF7N5O4S.C19H17F7N4O.C7H3Cl2NO3S.C7H4ClNO.ClH/c1-12-17(28)8-19(39(12)44(41,42)22-7-15-21(43-22)4-5-35-23(15)27)20(40)3-2-13-6-18(36-11-16(13)25(29,30)31)14-9-37-24(38-10-14)26(32,33)34;1-9-13(20)5-15(30-9)16(31)3-2-10-4-14(27-8-12(10)18(21,22)23)11-6-28-17(29-7-11)19(24,25)26;8-7-4-3-6(14(9,11)12)13-5(4)1-2-10-7;8-7-5-2-4-10-6(5)1-3-9-7;/h4-7,9-12,17,19H,2-3,8H2,1H3;4,6-9,13,15,30H,2-3,5H2,1H3;1-3H;1-4H;1H/t12-,17+,19-;9-,13+,15-;;;/m00.../s1.

What are the key properties of 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride?

4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride has a molecular weight of 1558.44 g/mol, XLogP of 15.54, 13 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chlorofuro[3,2-c]pyridine;4-chlorofuro[3,2-c]pyridine-2-sulfonyl chloride;1-[(2S,4R,5S)-1-(4-chlorofuro[3,2-c]pyridin-2-yl)sulfonyl-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S,4R,5S)-4-fluoro-5-methylpyrrolidin-2-yl]-3-[5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;hydrochloride is sourced from PubChem (CID 157446866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).