5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide

C19H14ClNO4S — CID 100554095

IUPAC5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide
SMILESCOc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C19H14ClNO4S/c1-24-17-9-6-12(20)10-19(17)26(22,23)21-13-7-8-15-14-4-2-3-5-16(14)25-18(15)11-13/h2-11,21H,1H3
InChIKeyICLACLILQVUQFX-UHFFFAOYSA-N
MW387.84 g/mol
LogP5.05
Rot. Bonds4

About 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide

5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide (PubChem CID 100554095) has the molecular formula C19H14ClNO4S and a molecular weight of 387.84 g/mol. Its IUPAC name is 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide.

Molecular Properties

Compound Name5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide
PubChem CID100554095
Molecular FormulaC19H14ClNO4S
Molecular Weight387.84 g/mol
Exact Mass387.03
IUPAC Name5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide
SMILESCOc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C19H14ClNO4S/c1-24-17-9-6-12(20)10-19(17)26(22,23)21-13-7-8-15-14-4-2-3-5-16(14)25-18(15)11-13/h2-11,21H,1H3
InChIKeyICLACLILQVUQFX-UHFFFAOYSA-N
XLogP5.05
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.84
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(3,4-dimethoxyphenyl)-2-methoxybenzenesulfonamide
CID 3706982
5-chloro-2-methoxy-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)benzenesulfonamide
CID 20962051
5-chloro-2-methoxy-N-(2-oxo-4-pyrrolidin-1-ylchromen-3-yl)benzenesulfonamide
CID 50778794
N-(4-chlorophenyl)-4-methoxynaphthalene-1-sulfonamide
CID 51702411
CID 70601990
CID 70601990
N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide
CID 100554015
5-chloro-2-methoxy-N-[3-(methoxymethyl)phenyl]benzenesulfonamide
CID 100562486
5-chloro-N-(5-chloro-2-methoxyphenyl)-2-methoxybenzenesulfonamide
CID 1326389
5-chloro-N-(2-hydroxyphenyl)-2-methoxybenzenesulfonamide
CID 4664874
5-[(2,5-dichlorophenyl)sulfonylamino]-2-methoxybenzenesulfonamide
CID 4826414
5-chloro-2-methoxy-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 3476038
4-methoxy-N-(2-methoxydibenzofuran-3-yl)naphthalene-1-sulfonamide
CID 2921082

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide?
The IUPAC name of 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide (CID 100554095) is 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide.
What is the SMILES notation for 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide?
The canonical SMILES for 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide is COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2c(c1)oc1ccccc12.
What is the InChIKey of 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide?
The InChIKey is ICLACLILQVUQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClNO4S/c1-24-17-9-6-12(20)10-19(17)26(22,23)21-13-7-8-15-14-4-2-3-5-16(14)25-18(15)11-13/h2-11,21H,1H3.
What are the key properties of 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide?
5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide has a molecular weight of 387.84 g/mol, XLogP of 5.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide is sourced from PubChem (CID 100554095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).