N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide

C23H17NO4S — CID 100554015

IUPACN-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide
SMILESCOc1ccc2cc(S(=O)(=O)Nc3ccc4c(c3)oc3ccccc34)ccc2c1
InChIInChI=1S/C23H17NO4S/c1-27-18-9-6-16-13-19(10-7-15(16)12-18)29(25,26)24-17-8-11-21-20-4-2-3-5-22(20)28-23(21)14-17/h2-14,24H,1H3
InChIKeyPCFBJEFRNUVSRJ-UHFFFAOYSA-N
MW403.46 g/mol
LogP5.55
Rot. Bonds4

About N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide

N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide (PubChem CID 100554015) has the molecular formula C23H17NO4S and a molecular weight of 403.46 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide
PubChem CID100554015
Molecular FormulaC23H17NO4S
Molecular Weight403.46 g/mol
Exact Mass403.09
IUPAC NameN-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide
SMILESCOc1ccc2cc(S(=O)(=O)Nc3ccc4c(c3)oc3ccccc34)ccc2c1
InChIInChI=1S/C23H17NO4S/c1-27-18-9-6-16-13-19(10-7-15(16)12-18)29(25,26)24-17-8-11-21-20-4-2-3-5-22(20)28-23(21)14-17/h2-14,24H,1H3
InChIKeyPCFBJEFRNUVSRJ-UHFFFAOYSA-N
XLogP5.55
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.46
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-dibenzofuran-3-yl-2-methoxybenzenesulfonamide
CID 100554095
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-4-methoxybenzenesulfonamide
CID 1098492
N-[4-(pyrazin-2-ylmethoxy)phenyl]dibenzofuran-3-sulfonamide
CID 166372900
4-methoxy-N-phenylbenzenesulfonamide
CID 835273
1-N-methyl-4-N-naphthalen-2-ylbenzene-1,4-disulfonamide
CID 86922484
N-[(2,4-dimethoxyphenyl)methyl]dibenzofuran-3-amine
CID 2981208
N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)phenyl]-4-methoxybenzenesulfonamide
CID 1324609
1-(cyclopropanecarbonyl)-N-dibenzofuran-3-yl-2,3-dihydroindole-5-sulfonamide
CID 100554084
N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide
CID 823335
6-methoxy-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]naphthalene-2-sulfonamide
CID 100540031
N-(9-ethylcarbazol-3-yl)-4-methoxybenzenesulfonamide
CID 1048274
N-(4-anilinophenyl)-4-methoxybenzenesulfonamide
CID 1011074

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide?
The IUPAC name of N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide (CID 100554015) is N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide.
What is the SMILES notation for N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide?
The canonical SMILES for N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide is COc1ccc2cc(S(=O)(=O)Nc3ccc4c(c3)oc3ccccc34)ccc2c1.
What is the InChIKey of N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide?
The InChIKey is PCFBJEFRNUVSRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO4S/c1-27-18-9-6-16-13-19(10-7-15(16)12-18)29(25,26)24-17-8-11-21-20-4-2-3-5-22(20)28-23(21)14-17/h2-14,24H,1H3.
What are the key properties of N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide?
N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide has a molecular weight of 403.46 g/mol, XLogP of 5.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-6-methoxynaphthalene-2-sulfonamide is sourced from PubChem (CID 100554015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).