N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide

C14H18N4O4S2 — CID 9192852

IUPACN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC
InChIInChI=1S/C14H18N4O4S2/c1-5-10-13(23-17-16-10)14(19)15-11-8-9(6-7-12(11)22-4)24(20,21)18(2)3/h6-8H,5H2,1-4H3,(H,15,19)
InChIKeyIJQUWOMXPXRUDT-UHFFFAOYSA-N
MW370.46 g/mol
LogP1.61
Rot. Bonds6

About N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide

N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide (PubChem CID 9192852) has the molecular formula C14H18N4O4S2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide
PubChem CID9192852
Molecular FormulaC14H18N4O4S2
Molecular Weight370.46 g/mol
Exact Mass370.08
IUPAC NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC
InChIInChI=1S/C14H18N4O4S2/c1-5-10-13(23-17-16-10)14(19)15-11-8-9(6-7-12(11)22-4)24(20,21)18(2)3/h6-8H,5H2,1-4H3,(H,15,19)
InChIKeyIJQUWOMXPXRUDT-UHFFFAOYSA-N
XLogP1.61
TPSA101.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide?
The IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide (CID 9192852) is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide.
What is the SMILES notation for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide?
The canonical SMILES for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC.
What is the InChIKey of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide?
The InChIKey is IJQUWOMXPXRUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O4S2/c1-5-10-13(23-17-16-10)14(19)15-11-8-9(6-7-12(11)22-4)24(20,21)18(2)3/h6-8H,5H2,1-4H3,(H,15,19).
What are the key properties of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide?
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide is sourced from PubChem (CID 9192852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).