N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide

C24H18F2N4O3S — CID 5330823

IUPACN-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide
SMILESNc1nc(Nc2ccccc2NS(=O)(=O)c2ccccc2)ccc1C(=O)c1c(F)cccc1F
InChIInChI=1S/C24H18F2N4O3S/c25-17-9-6-10-18(26)22(17)23(31)16-13-14-21(29-24(16)27)28-19-11-4-5-12-20(19)30-34(32,33)15-7-2-1-3-8-15/h1-14,30H,(H3,27,28,29)
InChIKeyZVPVPYCGZWPGFO-UHFFFAOYSA-N
MW480.50 g/mol
LogP4.72
Rot. Bonds7

About N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide

N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide (PubChem CID 5330823) has the molecular formula C24H18F2N4O3S and a molecular weight of 480.50 g/mol. Its IUPAC name is N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide
PubChem CID5330823
Molecular FormulaC24H18F2N4O3S
Molecular Weight480.50 g/mol
Exact Mass480.11
IUPAC NameN-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide
SMILESNc1nc(Nc2ccccc2NS(=O)(=O)c2ccccc2)ccc1C(=O)c1c(F)cccc1F
InChIInChI=1S/C24H18F2N4O3S/c25-17-9-6-10-18(26)22(17)23(31)16-13-14-21(29-24(16)27)28-19-11-4-5-12-20(19)30-34(32,33)15-7-2-1-3-8-15/h1-14,30H,(H3,27,28,29)
InChIKeyZVPVPYCGZWPGFO-UHFFFAOYSA-N
XLogP4.72
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.50
LogP ≤ 54.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide with MolForge

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Related Compounds

3-Acyl-2,6-diaminopyridine deriv. 2m
CID 5330827
3-Acyl-2,6-diaminopyridine deriv. 2o
CID 5330829
3-Acyl-2,6-diaminopyridine deriv. 2p
CID 5330830
3-Acyl-2,6-diaminopyridine deriv. 2r
CID 5330832
3-Acyl-2,6-diaminopyridine deriv. 2s
CID 5330833
3-Acyl-2,6-diaminopyridine deriv. 2t
CID 5330834
3-Acyl-2,6-diaminopyridine deriv. 2a
CID 5330815
3-Acyl-2,6-diaminopyridine deriv. 2e
CID 5330819
3-Acyl-2,6-diaminopyridine deriv. 2f
CID 5330820
3-Acyl-2,6-diaminopyridine deriv. 2g
CID 5330821
3-Acyl-2,6-diaminopyridine deriv. 2h
CID 5330822
3-Acyl-2,6-diaminopyridine deriv. 2q
CID 5330831

Frequently Asked Questions

What is the IUPAC name of N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide?
The IUPAC name of N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide (CID 5330823) is N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide.
What is the SMILES notation for N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide?
The canonical SMILES for N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide is Nc1nc(Nc2ccccc2NS(=O)(=O)c2ccccc2)ccc1C(=O)c1c(F)cccc1F.
What is the InChIKey of N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide?
The InChIKey is ZVPVPYCGZWPGFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F2N4O3S/c25-17-9-6-10-18(26)22(17)23(31)16-13-14-21(29-24(16)27)28-19-11-4-5-12-20(19)30-34(32,33)15-7-2-1-3-8-15/h1-14,30H,(H3,27,28,29).
What are the key properties of N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide?
N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide has a molecular weight of 480.50 g/mol, XLogP of 4.72, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[6-amino-5-(2,6-difluorobenzoyl)-2-pyridinyl]amino]phenyl]benzenesulfonamide is sourced from PubChem (CID 5330823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).