5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide

C10H8ClN3O2S3 — CID 110872204

IUPAC5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1csc2nccn12)c1ccc(Cl)s1
InChIInChI=1S/C10H8ClN3O2S3/c11-8-1-2-9(18-8)19(15,16)13-5-7-6-17-10-12-3-4-14(7)10/h1-4,6,13H,5H2
InChIKeyMHWVZVYYNNTQFZ-UHFFFAOYSA-N
MW333.85 g/mol
LogP2.59
Rot. Bonds4

About 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide

5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide (PubChem CID 110872204) has the molecular formula C10H8ClN3O2S3 and a molecular weight of 333.85 g/mol. Its IUPAC name is 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide
PubChem CID110872204
Molecular FormulaC10H8ClN3O2S3
Molecular Weight333.85 g/mol
Exact Mass332.95
IUPAC Name5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1csc2nccn12)c1ccc(Cl)s1
InChIInChI=1S/C10H8ClN3O2S3/c11-8-1-2-9(18-8)19(15,16)13-5-7-6-17-10-12-3-4-14(7)10/h1-4,6,13H,5H2
InChIKeyMHWVZVYYNNTQFZ-UHFFFAOYSA-N
XLogP2.59
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.85
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)ethanesulfonamide
CID 110872189
4-fluoro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)-3-methylbenzenesulfonamide
CID 110872199
5-chloro-N-(1,3-thiazol-4-ylmethyl)thiophene-2-sulfonamide
CID 110717389
N-[(1-benzylimidazol-2-yl)methyl]-5-chlorothiophene-2-sulfonamide
CID 75400421
5-chloro-N-(1H-imidazol-2-ylmethyl)thiophene-2-sulfonamide
CID 64529732
5-chloro-N-[(2-methyl-1,3-thiazol-4-yl)methyl]thiophene-2-sulfonamide
CID 110717446
5-chloro-N-[3-(2-methylimidazol-1-yl)propyl]thiophene-2-sulfonamide
CID 56684506
5-[[(5-chlorothiophen-2-yl)sulfonylamino]methyl]pyridine-2-carboxylic acid
CID 81098757
5-chloro-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 19683573
5-chloro-N-[(2-hydroxyphenyl)methyl]thiophene-2-sulfonamide
CID 113317167
5-chloro-N-[(1-methylbenzimidazol-5-yl)methyl]thiophene-2-sulfonamide
CID 110785866
4-[[(5-chlorothiophen-2-yl)sulfonylamino]methyl]benzoic acid
CID 43235820

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide (CID 110872204) is 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide is O=S(=O)(NCc1csc2nccn12)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is MHWVZVYYNNTQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O2S3/c11-8-1-2-9(18-8)19(15,16)13-5-7-6-17-10-12-3-4-14(7)10/h1-4,6,13H,5H2.
What are the key properties of 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide?
5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 333.85 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 110872204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).