5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide

C8H7ClN2O2S3 — CID 110717389

IUPAC5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1cscn1)c1ccc(Cl)s1
InChIInChI=1S/C8H7ClN2O2S3/c9-7-1-2-8(15-7)16(12,13)11-3-6-4-14-5-10-6/h1-2,4-5,11H,3H2
InChIKeyZZGGZNVBBSBOAD-UHFFFAOYSA-N
MW294.81 g/mol
LogP2.34
Rot. Bonds4

About 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide

5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide (PubChem CID 110717389) has the molecular formula C8H7ClN2O2S3 and a molecular weight of 294.81 g/mol. Its IUPAC name is 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide
PubChem CID110717389
Molecular FormulaC8H7ClN2O2S3
Molecular Weight294.81 g/mol
Exact Mass293.94
IUPAC Name5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1cscn1)c1ccc(Cl)s1
InChIInChI=1S/C8H7ClN2O2S3/c9-7-1-2-8(15-7)16(12,13)11-3-6-4-14-5-10-6/h1-2,4-5,11H,3H2
InChIKeyZZGGZNVBBSBOAD-UHFFFAOYSA-N
XLogP2.34
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.81
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[(2-methyl-1,3-thiazol-4-yl)methyl]thiophene-2-sulfonamide
CID 110717446
5-chloro-4-nitro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide
CID 80741647
5-chloro-N-[(2-methyl-1,3-oxazol-4-yl)methyl]thiophene-2-sulfonamide
CID 110714699
3-chloro-4-methyl-N-(1,3-thiazol-4-ylmethyl)benzenesulfonamide
CID 49458302
5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide
CID 110872204
5-chloro-N-(1H-imidazol-2-ylmethyl)thiophene-2-sulfonamide
CID 64529732
5-chloro-2-methoxy-N-(1,3-thiazol-4-ylmethyl)benzenesulfonamide
CID 110717401
4-amino-3-chloro-N-(1,3-thiazol-4-ylmethyl)benzenesulfonamide
CID 113288438
4-(aminomethyl)-N-(1,3-thiazol-4-ylmethyl)benzenesulfonamide
CID 63824323
5-[[(5-chlorothiophen-2-yl)sulfonylamino]methyl]pyridine-2-carboxylic acid
CID 81098757
5-chloro-N-[(2-hydroxyphenyl)methyl]thiophene-2-sulfonamide
CID 113317167
4-[[(5-chlorothiophen-2-yl)sulfonylamino]methyl]benzoic acid
CID 43235820

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide (CID 110717389) is 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide is O=S(=O)(NCc1cscn1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is ZZGGZNVBBSBOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2O2S3/c9-7-1-2-8(15-7)16(12,13)11-3-6-4-14-5-10-6/h1-2,4-5,11H,3H2.
What are the key properties of 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide?
5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 294.81 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 110717389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).