7-methoxy-N-phenylquinoline-4-sulfonamide

C16H14N2O3S — CID 69089978

IUPAC7-methoxy-N-phenylquinoline-4-sulfonamide
SMILESCOc1ccc2c(S(=O)(=O)Nc3ccccc3)ccnc2c1
InChIInChI=1S/C16H14N2O3S/c1-21-13-7-8-14-15(11-13)17-10-9-16(14)22(19,20)18-12-5-3-2-4-6-12/h2-11,18H,1H3
InChIKeyINDYXODSBAMZNS-UHFFFAOYSA-N
MW314.37 g/mol
LogP3.04
Rot. Bonds4

About 7-methoxy-N-phenylquinoline-4-sulfonamide

7-methoxy-N-phenylquinoline-4-sulfonamide (PubChem CID 69089978) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is 7-methoxy-N-phenylquinoline-4-sulfonamide.

Molecular Properties

Compound Name7-methoxy-N-phenylquinoline-4-sulfonamide
PubChem CID69089978
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC Name7-methoxy-N-phenylquinoline-4-sulfonamide
SMILESCOc1ccc2c(S(=O)(=O)Nc3ccccc3)ccnc2c1
InChIInChI=1S/C16H14N2O3S/c1-21-13-7-8-14-15(11-13)17-10-9-16(14)22(19,20)18-12-5-3-2-4-6-12/h2-11,18H,1H3
InChIKeyINDYXODSBAMZNS-UHFFFAOYSA-N
XLogP3.04
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-phenylquinoline-4-sulfonamide?
The IUPAC name of 7-methoxy-N-phenylquinoline-4-sulfonamide (CID 69089978) is 7-methoxy-N-phenylquinoline-4-sulfonamide.
What is the SMILES notation for 7-methoxy-N-phenylquinoline-4-sulfonamide?
The canonical SMILES for 7-methoxy-N-phenylquinoline-4-sulfonamide is COc1ccc2c(S(=O)(=O)Nc3ccccc3)ccnc2c1.
What is the InChIKey of 7-methoxy-N-phenylquinoline-4-sulfonamide?
The InChIKey is INDYXODSBAMZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c1-21-13-7-8-14-15(11-13)17-10-9-16(14)22(19,20)18-12-5-3-2-4-6-12/h2-11,18H,1H3.
What are the key properties of 7-methoxy-N-phenylquinoline-4-sulfonamide?
7-methoxy-N-phenylquinoline-4-sulfonamide has a molecular weight of 314.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-phenylquinoline-4-sulfonamide is sourced from PubChem (CID 69089978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).