N,2-dimethyl-5-(thieno[2,3-d]pyrimidin-4-ylamino)benzenesulfonamide
Basic information
- CAS
851903-01-0- Standard SMILES
CNS(=O)(=O)c1cc(Nc2ncnc3sccc23)ccc1C- InChIKey
XJMYGBBUQAIYKB-UHFFFAOYSA-N- Molecular formula
- C14H14N4O2S2
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.05581805
Names & identifiers
- Preferred name
- N,2-dimethyl-5-(thieno[2,3-d]pyrimidin-4-ylamino)benzenesulfonamide
- IUPAC
- N,2-dimethyl-5-(thieno[2,3-d]pyrimidin-4-ylamino)benzenesulfonamide
Names & synonyms
N,2-dimethyl-5-(thieno[2,3-d]pyrimidin-4-ylamino)benzenesulfonamideMLS001174805CHEMBL1327121DTXSID301325286HMS2869F23AKOS034433952851903-01-0SMR000589005AB00731357-01SR-01000064885SR-01000064885-1Z52636383
Show more names
N,2-Dimethyl-5-[(thieno[2,3-d]pyrimidin-4-yl)amino]benzene-1-sulfonamide
Database identifiers
- CAS
851903-01-0- PubChem CID
- 4884636
- DTXSID
DTXSID301325286- ChEMBL
CHEMBL1327121
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 482
Experimental & physicochemical properties
Solubility2.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…