HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

(3-Pyridylmethyl)(2-thienylsulfonyl)amine

HCID 671065
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
301683-41-0
Standard SMILES
O=S(=O)(NCc1cccnc1)c1cccs1
InChIKey
PWWYYMTYFYWPDY-UHFFFAOYSA-N
Molecular formula
C10H10N2O2S2
Average molar mass
254.3 g/mol
Monoisotopic mass
254.01836991

Names & identifiers

Preferred name
(3-Pyridylmethyl)(2-thienylsulfonyl)amine
IUPAC
N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide

Names & synonyms

N-(3-pyridinylmethyl)-2-thiophenesulfonamide301683-41-0(3-pyridylmethyl)(2-thienylsulfonyl)amineN-(pyridin-3-ylmethyl)thiophene-2-sulfonamideN-[(PYRIDIN-3-YL)METHYL]THIOPHENE-2-SULFONAMIDECerep_000451Cambridge id 5807570Oprea1_074433Oprea1_528273MLS000054530CHEMBL1588840HMS527G13
Show more names
DTXSID601258002HMS2501A07HMS5175F14CCG-27382STK110890AKOS001034448SMR000060916ST019610

Database identifiers

CAS
301683-41-0
PubChem CID
671065
DTXSID
DTXSID601258002
ChEMBL
CHEMBL1588840

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
95.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
313

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes