N-[4-(4-formamidophenyl)sulfonylphenyl]formamide

C14H12N2O4S — CID 23230

IUPACN-[4-(4-formamidophenyl)sulfonylphenyl]formamide
SMILESO=CNc1ccc(S(=O)(=O)c2ccc(NC=O)cc2)cc1
InChIInChI=1S/C14H12N2O4S/c17-9-15-11-1-5-13(6-2-11)21(19,20)14-7-3-12(4-8-14)16-10-18/h1-10H,(H,15,17)(H,16,18)
InChIKeyNOWADDNUCMOPLH-UHFFFAOYSA-N
MW304.33 g/mol
LogP1.66
Rot. Bonds6

About N-[4-(4-formamidophenyl)sulfonylphenyl]formamide

N-[4-(4-formamidophenyl)sulfonylphenyl]formamide (PubChem CID 23230) has the molecular formula C14H12N2O4S and a molecular weight of 304.33 g/mol. Its IUPAC name is N-[4-(4-formamidophenyl)sulfonylphenyl]formamide.

Molecular Properties

Compound NameN-[4-(4-formamidophenyl)sulfonylphenyl]formamide
PubChem CID23230
Molecular FormulaC14H12N2O4S
Molecular Weight304.33 g/mol
Exact Mass304.05
IUPAC NameN-[4-(4-formamidophenyl)sulfonylphenyl]formamide
SMILESO=CNc1ccc(S(=O)(=O)c2ccc(NC=O)cc2)cc1
InChIInChI=1S/C14H12N2O4S/c17-9-15-11-1-5-13(6-2-11)21(19,20)14-7-3-12(4-8-14)16-10-18/h1-10H,(H,15,17)(H,16,18)
InChIKeyNOWADDNUCMOPLH-UHFFFAOYSA-N
XLogP1.66
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-formamidophenyl)sulfonylphenyl]formamide?
The IUPAC name of N-[4-(4-formamidophenyl)sulfonylphenyl]formamide (CID 23230) is N-[4-(4-formamidophenyl)sulfonylphenyl]formamide.
What is the SMILES notation for N-[4-(4-formamidophenyl)sulfonylphenyl]formamide?
The canonical SMILES for N-[4-(4-formamidophenyl)sulfonylphenyl]formamide is O=CNc1ccc(S(=O)(=O)c2ccc(NC=O)cc2)cc1.
What is the InChIKey of N-[4-(4-formamidophenyl)sulfonylphenyl]formamide?
The InChIKey is NOWADDNUCMOPLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4S/c17-9-15-11-1-5-13(6-2-11)21(19,20)14-7-3-12(4-8-14)16-10-18/h1-10H,(H,15,17)(H,16,18).
What are the key properties of N-[4-(4-formamidophenyl)sulfonylphenyl]formamide?
N-[4-(4-formamidophenyl)sulfonylphenyl]formamide has a molecular weight of 304.33 g/mol, XLogP of 1.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-formamidophenyl)sulfonylphenyl]formamide is sourced from PubChem (CID 23230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).