N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

C10H8F2N2O3S2 — CID 60712773

IUPACN-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C10H8F2N2O3S2/c1-5-9(18-10(15)13-5)19(16,17)14-8-3-6(11)2-7(12)4-8/h2-4,14H,1H3,(H,13,15)
InChIKeyUNIRTSCCKMTFBY-UHFFFAOYSA-N
MW306.32 g/mol
LogP1.82
Rot. Bonds3

About N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (PubChem CID 60712773) has the molecular formula C10H8F2N2O3S2 and a molecular weight of 306.32 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
PubChem CID60712773
Molecular FormulaC10H8F2N2O3S2
Molecular Weight306.32 g/mol
Exact Mass305.99
IUPAC NameN-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C10H8F2N2O3S2/c1-5-9(18-10(15)13-5)19(16,17)14-8-3-6(11)2-7(12)4-8/h2-4,14H,1H3,(H,13,15)
InChIKeyUNIRTSCCKMTFBY-UHFFFAOYSA-N
XLogP1.82
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (CID 60712773) is N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is UNIRTSCCKMTFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O3S2/c1-5-9(18-10(15)13-5)19(16,17)14-8-3-6(11)2-7(12)4-8/h2-4,14H,1H3,(H,13,15).
What are the key properties of N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 306.32 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 60712773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).