2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide

C14H14Cl2N2O3S2 — CID 2813424

IUPAC2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide
SMILESO=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C14H14Cl2N2O3S2/c15-13-9-12(14(16)22-13)23(19,20)17-10-3-1-2-4-11(10)18-5-7-21-8-6-18/h1-4,9,17H,5-8H2
InChIKeySDYCZTVFAQXVGM-UHFFFAOYSA-N
MW393.32 g/mol
LogP3.69
Rot. Bonds4

About 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide

2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide (PubChem CID 2813424) has the molecular formula C14H14Cl2N2O3S2 and a molecular weight of 393.32 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide
PubChem CID2813424
Molecular FormulaC14H14Cl2N2O3S2
Molecular Weight393.32 g/mol
Exact Mass391.98
IUPAC Name2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide
SMILESO=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C14H14Cl2N2O3S2/c15-13-9-12(14(16)22-13)23(19,20)17-10-3-1-2-4-11(10)18-5-7-21-8-6-18/h1-4,9,17H,5-8H2
InChIKeySDYCZTVFAQXVGM-UHFFFAOYSA-N
XLogP3.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.32
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 2111037
CID 2111037
CID 893728
CID 893728
CID 2813371
CID 2813371
CID 2572988
CID 2572988
CID 3607355
CID 3607355
CID 4794708
CID 4794708
CID 779290
CID 779290
CID 3917496
CID 3917496
CID 2124908
CID 2124908
CID 2161790
CID 2161790
CID 4842368
CID 4842368
CID 735898
CID 735898

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide (CID 2813424) is 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide is O=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide?
The InChIKey is SDYCZTVFAQXVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O3S2/c15-13-9-12(14(16)22-13)23(19,20)17-10-3-1-2-4-11(10)18-5-7-21-8-6-18/h1-4,9,17H,5-8H2.
What are the key properties of 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide?
2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide has a molecular weight of 393.32 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-morpholin-4-ylphenyl)thiophene-3-sulfonamide is sourced from PubChem (CID 2813424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).