N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide

C10H7N3O2S4 — CID 108783410

IUPACN-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1nnc(-c2cccs2)s1)c1cccs1
InChIInChI=1S/C10H7N3O2S4/c14-19(15,8-4-2-6-17-8)13-10-12-11-9(18-10)7-3-1-5-16-7/h1-6H,(H,12,13)
InChIKeyDYLWGVBMQPHXBW-UHFFFAOYSA-N
MW329.45 g/mol
LogP3.13
Rot. Bonds4

About N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide

N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide (PubChem CID 108783410) has the molecular formula C10H7N3O2S4 and a molecular weight of 329.45 g/mol. Its IUPAC name is N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
PubChem CID108783410
Molecular FormulaC10H7N3O2S4
Molecular Weight329.45 g/mol
Exact Mass328.94
IUPAC NameN-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1nnc(-c2cccs2)s1)c1cccs1
InChIInChI=1S/C10H7N3O2S4/c14-19(15,8-4-2-6-17-8)13-10-12-11-9(18-10)7-3-1-5-16-7/h1-6H,(H,12,13)
InChIKeyDYLWGVBMQPHXBW-UHFFFAOYSA-N
XLogP3.13
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(4-thiophen-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide
CID 8603530
2-thiophen-2-yl-5-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-1,3,4-thiadiazole
CID 108780934
N-(4,7-dimethyl-1,3-benzothiazol-2-yl)thiophene-2-sulfonamide
CID 16934138
N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
CID 1080987
N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55793963
2-chloro-5-thiophen-2-yl-1,3,4-thiadiazole
CID 14091186
N-(4,5-dichloro-1,3-benzothiazol-2-yl)thiophene-2-sulfonamide
CID 16934134
4-(thiophen-2-ylsulfonylamino)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)benzamide
CID 55376558
N-(2,6-dimethylphenyl)thiophene-2-sulfonamide
CID 765837
N-fluorothiophene-2-sulfonamide
CID 175398216
2-[(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 4252560
N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)octadecanamide
CID 108744035

Frequently Asked Questions

What is the IUPAC name of N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide (CID 108783410) is N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide is O=S(=O)(Nc1nnc(-c2cccs2)s1)c1cccs1.
What is the InChIKey of N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The InChIKey is DYLWGVBMQPHXBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O2S4/c14-19(15,8-4-2-6-17-8)13-10-12-11-9(18-10)7-3-1-5-16-7/h1-6H,(H,12,13).
What are the key properties of N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide has a molecular weight of 329.45 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 108783410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).