2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole

C11H13N3O2S2 — CID 18870688

IUPAC2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole
SMILESCN(C)S(=O)(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H13N3O2S2/c1-14(2)18(15,16)13-11-12-10(8-17-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)
InChIKeyNHCNQEGDRLIFOL-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.03
Rot. Bonds4

About 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole

2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole (PubChem CID 18870688) has the molecular formula C11H13N3O2S2 and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole
PubChem CID18870688
Molecular FormulaC11H13N3O2S2
Molecular Weight283.38 g/mol
Exact Mass283.04
IUPAC Name2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole
SMILESCN(C)S(=O)(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H13N3O2S2/c1-14(2)18(15,16)13-11-12-10(8-17-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)
InChIKeyNHCNQEGDRLIFOL-UHFFFAOYSA-N
XLogP2.03
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-bromophenyl)-2-(dimethylsulfamoylamino)-1,3-thiazole
CID 18870687
4-phenyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide
CID 10222134
3,4-dimethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide;ethane
CID 90842938
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
N-[4-(2-anilino-1,3-thiazol-4-yl)phenyl]methanesulfonamide
CID 9330073
4-amino-2-chloro-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide
CID 10761363
N,N-dimethyl-2-[(4-phenyl-1,3-thiazol-2-yl)methylamino]ethanesulfonamide
CID 106336093
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]methanesulfonamide
CID 3254844
4-(4-aminophenyl)-N-(methylsulfamoyl)-1,3-thiazol-2-amine
CID 114804525
N,N-dimethyl-4-[2-(4-phenoxyanilino)-1,3-thiazol-4-yl]benzenesulfonamide
CID 58910466
N-[4-[2-[[(E)-2-phenylethenyl]sulfonylamino]-1,3-thiazol-4-yl]phenyl]acetamide
CID 8504630
N-[[4-(dimethylamino)phenyl]methylideneamino]-4-phenyl-1,3-thiazol-2-amine
CID 3295773

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole?
The IUPAC name of 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole (CID 18870688) is 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole.
What is the SMILES notation for 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole?
The canonical SMILES for 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole is CN(C)S(=O)(=O)Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole?
The InChIKey is NHCNQEGDRLIFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S2/c1-14(2)18(15,16)13-11-12-10(8-17-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13).
What are the key properties of 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole?
2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole has a molecular weight of 283.38 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylsulfamoylamino)-4-phenyl-1,3-thiazole is sourced from PubChem (CID 18870688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).