N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide

C127H110Cl3N13O25S7 — CID 160763816

IUPACN-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2cc3ccccc3o2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1
InChIInChI=1S/C23H19ClN2O5S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C21H20N2O3S.C20H13ClN2O4S2/c1-14(2)30-17-7-9-18(10-8-17)32(28,29)26-23-19(12-16(24)13-25-23)22(27)21-11-15-5-3-4-6-20(15)31-21;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;1-15(2)16-8-10-18(11-9-16)27(25,26)23-20-14-22-13-12-19(20)21(24)17-6-4-3-5-7-17;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16/h3-14H,1-2H3,(H,25,26);3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);3-15,23H,1-2H3;1-12H,(H,22,23)
InChIKeyRYKNEWYRVLHWOP-UHFFFAOYSA-N
MW2549.17 g/mol
LogP27.22
Rot. Bonds40

About N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide

N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide (PubChem CID 160763816) has the molecular formula C127H110Cl3N13O25S7 and a molecular weight of 2549.17 g/mol. Its IUPAC name is N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide.

Molecular Properties

Compound NameN-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
PubChem CID160763816
Molecular FormulaC127H110Cl3N13O25S7
Molecular Weight2549.17 g/mol
Exact Mass2545.48
IUPAC NameN-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2cc3ccccc3o2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1
InChIInChI=1S/C23H19ClN2O5S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C21H20N2O3S.C20H13ClN2O4S2/c1-14(2)30-17-7-9-18(10-8-17)32(28,29)26-23-19(12-16(24)13-25-23)22(27)21-11-15-5-3-4-6-20(15)31-21;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;1-15(2)16-8-10-18(11-9-16)27(25,26)23-20-14-22-13-12-19(20)21(24)17-6-4-3-5-7-17;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16/h3-14H,1-2H3,(H,25,26);3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);3-15,23H,1-2H3;1-12H,(H,22,23)
InChIKeyRYKNEWYRVLHWOP-UHFFFAOYSA-N
XLogP27.22
TPSA553.89 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds40
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002549.17
LogP ≤ 527.22
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The IUPAC name of N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide (CID 160763816) is N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide.
What is the SMILES notation for N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The canonical SMILES for N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide is CC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2cc3ccccc3o2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2cnccc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1.
What is the InChIKey of N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
The InChIKey is RYKNEWYRVLHWOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN2O5S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C21H20N2O3S.C20H13ClN2O4S2/c1-14(2)30-17-7-9-18(10-8-17)32(28,29)26-23-19(12-16(24)13-25-23)22(27)21-11-15-5-3-4-6-20(15)31-21;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;1-15(2)16-8-10-18(11-9-16)27(25,26)23-20-14-22-13-12-19(20)21(24)17-6-4-3-5-7-17;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16/h3-14H,1-2H3,(H,25,26);3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);3-15,23H,1-2H3;1-12H,(H,22,23).
What are the key properties of N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide?
N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide has a molecular weight of 2549.17 g/mol, XLogP of 27.22, 40 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-benzofuran-2-carbonyl)-5-chloro-2-pyridinyl]-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(4-benzoyl-3-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide is sourced from PubChem (CID 160763816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).