N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide

C23H17Cl2N5O3S — CID 69208595

IUPACN-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide
SMILESNC1c2ccoc2N=C(c2cccnc2)N1c1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C23H17Cl2N5O3S/c24-18-4-1-5-19(20(18)25)34(31,32)29-15-6-8-16(9-7-15)30-21(26)17-10-12-33-23(17)28-22(30)14-3-2-11-27-13-14/h1-13,21,29H,26H2
InChIKeyNDYJRTJVZSCAGJ-UHFFFAOYSA-N
MW514.39 g/mol
LogP5.34
Rot. Bonds5

About N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide

N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide (PubChem CID 69208595) has the molecular formula C23H17Cl2N5O3S and a molecular weight of 514.39 g/mol. Its IUPAC name is N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide.

Molecular Properties

Compound NameN-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide
PubChem CID69208595
Molecular FormulaC23H17Cl2N5O3S
Molecular Weight514.39 g/mol
Exact Mass513.04
IUPAC NameN-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide
SMILESNC1c2ccoc2N=C(c2cccnc2)N1c1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C23H17Cl2N5O3S/c24-18-4-1-5-19(20(18)25)34(31,32)29-15-6-8-16(9-7-15)30-21(26)17-10-12-33-23(17)28-22(30)14-3-2-11-27-13-14/h1-13,21,29H,26H2
InChIKeyNDYJRTJVZSCAGJ-UHFFFAOYSA-N
XLogP5.34
TPSA113.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.39
LogP ≤ 55.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[4-(4-amino-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2-chlorobenzenesulfonamide
CID 69205555
3-chloro-N-(3-chlorophenyl)-2-pyridin-3-ylbenzenesulfonamide
CID 175711710
N-[4-(4-amino-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,5-dimethylbenzenesulfonamide
CID 69209143
(2S)-2-[4-[(2,3-dichlorophenyl)sulfonylamino]phenyl]butanamide
CID 177299430
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]pyridine-3-sulfonamide
CID 25036762
2,6-dichloro-N-pyridin-3-ylbenzenesulfonamide
CID 890470
N-(2-bromo-3-pyridinyl)-2,3-dichlorobenzenesulfonamide
CID 103816094
2,3-dichloro-N-[(1R)-1-pyridin-3-ylethyl]benzenesulfonamide
CID 40673104
2,3-dichloro-N-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide
CID 41349100
2,3-dichloro-N-[3-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 8519287
2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3859357
N-[[5-[[4-(4-amino-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]sulfamoyl]thiophen-2-yl]methyl]benzamide
CID 69210192

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide?
The IUPAC name of N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide (CID 69208595) is N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide.
What is the SMILES notation for N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide?
The canonical SMILES for N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide is NC1c2ccoc2N=C(c2cccnc2)N1c1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)cc1.
What is the InChIKey of N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide?
The InChIKey is NDYJRTJVZSCAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17Cl2N5O3S/c24-18-4-1-5-19(20(18)25)34(31,32)29-15-6-8-16(9-7-15)30-21(26)17-10-12-33-23(17)28-22(30)14-3-2-11-27-13-14/h1-13,21,29H,26H2.
What are the key properties of N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide?
N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide has a molecular weight of 514.39 g/mol, XLogP of 5.34, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-amino-2-pyridin-3-yl-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]-2,3-dichlorobenzenesulfonamide is sourced from PubChem (CID 69208595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).