5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide

C9H8ClNO2S3 — CID 3822285

IUPAC5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1cccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H8ClNO2S3/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h1-5,11H,6H2
InChIKeyMBIORAZRRQUUTQ-UHFFFAOYSA-N
MW293.82 g/mol
LogP2.94
Rot. Bonds4

About 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide

5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide (PubChem CID 3822285) has the molecular formula C9H8ClNO2S3 and a molecular weight of 293.82 g/mol. Its IUPAC name is 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
PubChem CID3822285
Molecular FormulaC9H8ClNO2S3
Molecular Weight293.82 g/mol
Exact Mass292.94
IUPAC Name5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1cccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H8ClNO2S3/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h1-5,11H,6H2
InChIKeyMBIORAZRRQUUTQ-UHFFFAOYSA-N
XLogP2.94
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.82
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-Thienylmethyl)-2,5-Thiophenedisulfonamide
CID 4293
(5-Thiophen-2-ylsulfonylthiophen-2-yl)methanamine;hydrochloride
CID 130345102
2-chloro-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 3732014
US10807974, Example 53
CID 130345103
US10807974, Example 60
CID 130358502
N-[(2-chlorophenyl)methyl]thiophene-2-sulfonamide
CID 971284
N-[(5-chlorothiophen-2-yl)methyl]-N-ethylethanesulfonamide
CID 61363022
N-[2,2,2-trichloro-1-(thiophen-2-yl)ethyl]benzenesulfonamide
CID 3126751
2,5-dichloro-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 898422
N-(4-chlorobenzyl)thiophene-2-sulfonamide
CID 880604
4-Chloro-N-(2,2,2-trichloro-1-(2-thienyl)ethyl)benzenesulfonamide
CID 2848635
N-[2,2,2-trichloro-1-(5-chlorothiophen-2-yl)ethyl]benzenesulfonamide
CID 4442856

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide (CID 3822285) is 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide is O=S(=O)(NCc1cccs1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is MBIORAZRRQUUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClNO2S3/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h1-5,11H,6H2.
What are the key properties of 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 293.82 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 3822285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).