N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide

C10H11N3O3S2 — CID 168652188

IUPACN-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide
SMILESO=CNc1ccc(S(=O)(=O)NC2=NCCS2)cc1
InChIInChI=1S/C10H11N3O3S2/c14-7-12-8-1-3-9(4-2-8)18(15,16)13-10-11-5-6-17-10/h1-4,7H,5-6H2,(H,11,13)(H,12,14)
InChIKeyPABHTAVPUIDAFD-UHFFFAOYSA-N
MW285.35 g/mol
LogP0.64
Rot. Bonds4

About N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide

N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide (PubChem CID 168652188) has the molecular formula C10H11N3O3S2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide
PubChem CID168652188
Molecular FormulaC10H11N3O3S2
Molecular Weight285.35 g/mol
Exact Mass285.02
IUPAC NameN-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide
SMILESO=CNc1ccc(S(=O)(=O)NC2=NCCS2)cc1
InChIInChI=1S/C10H11N3O3S2/c14-7-12-8-1-3-9(4-2-8)18(15,16)13-10-11-5-6-17-10/h1-4,7H,5-6H2,(H,11,13)(H,12,14)
InChIKeyPABHTAVPUIDAFD-UHFFFAOYSA-N
XLogP0.64
TPSA87.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

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CID 135413939
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N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide
CID 852123
4-(formylamino)-N,N-dimethylbenzenesulfonamide
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CID 3529995
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-sulfamoylphenyl)butanamide
CID 2871292
N-(4-Cyclohexylsulfamoyl-phenyl)-2-(4,5-dihydro-thiazol-2-ylsulfanyl)-acetamide
CID 1140658
N-(4-((2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)sulfonyl)phenyl)acetamide
CID 2148546
N-[4-[(2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)sulfonyl]phenyl]acetamide
CID 2148556
N-[4-(Azepane-1-sulfonyl)-phenyl]-2-(4,5-dihydro-thiazol-2-ylsulfanyl)-acetamide
CID 645851
2-[[[4-(Acetylamino)phenyl]sulfonyl]methylamino]-N-(4,5-dihydro-2-thiazolyl)acetamide
CID 2110803
N,N-dimethyl-3-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]benzene-1-sulfonamide
CID 3434496

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide?
The IUPAC name of N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide (CID 168652188) is N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide.
What is the SMILES notation for N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide?
The canonical SMILES for N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide is O=CNc1ccc(S(=O)(=O)NC2=NCCS2)cc1.
What is the InChIKey of N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide?
The InChIKey is PABHTAVPUIDAFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3S2/c14-7-12-8-1-3-9(4-2-8)18(15,16)13-10-11-5-6-17-10/h1-4,7H,5-6H2,(H,11,13)(H,12,14).
What are the key properties of N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide?
N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide has a molecular weight of 285.35 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]formamide is sourced from PubChem (CID 168652188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).