N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide

C18H15BrN2O5S — CID 25348399

IUPACN-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccoc2)cc1S(=O)(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C18H15BrN2O5S/c1-25-16-7-6-15(20-18(22)12-8-9-26-11-12)10-17(16)27(23,24)21-14-4-2-13(19)3-5-14/h2-11,21H,1H3,(H,20,22)
InChIKeyRZBIQJDAPAENNB-UHFFFAOYSA-N
MW451.30 g/mol
LogP4.10
Rot. Bonds6

About N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide

N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide (PubChem CID 25348399) has the molecular formula C18H15BrN2O5S and a molecular weight of 451.30 g/mol. Its IUPAC name is N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide
PubChem CID25348399
Molecular FormulaC18H15BrN2O5S
Molecular Weight451.30 g/mol
Exact Mass449.99
IUPAC NameN-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccoc2)cc1S(=O)(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C18H15BrN2O5S/c1-25-16-7-6-15(20-18(22)12-8-9-26-11-12)10-17(16)27(23,24)21-14-4-2-13(19)3-5-14/h2-11,21H,1H3,(H,20,22)
InChIKeyRZBIQJDAPAENNB-UHFFFAOYSA-N
XLogP4.10
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.30
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]benzamide
CID 34081382
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]-4-fluorobenzamide
CID 26850573
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 26951683
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]-2,6-dimethylbenzamide
CID 71771105
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]butanamide
CID 30877312
3-[(4-bromophenyl)sulfamoyl]-N-(3-ethynylphenyl)-4-methoxybenzamide
CID 30285125
3-[(4-bromophenyl)sulfamoyl]-4-methoxybenzamide
CID 166186504
(2E,4E)-N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]hexa-2,4-dienamide
CID 35745347
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]-1-methyl-2-(trifluoromethyl)imidazole-4-carboxamide
CID 156859929
3,5-difluoro-N-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 26851473
3-[(4-bromophenyl)sulfamoyl]-4-methoxy-N-(3-methylbutan-2-yl)benzamide
CID 43016571
methyl (2S)-2-[[3-[(4-bromophenyl)sulfamoyl]-4-methoxybenzoyl]amino]propanoate
CID 25342326

Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide?
The IUPAC name of N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide (CID 25348399) is N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide.
What is the SMILES notation for N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide?
The canonical SMILES for N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide is COc1ccc(NC(=O)c2ccoc2)cc1S(=O)(=O)Nc1ccc(Br)cc1.
What is the InChIKey of N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide?
The InChIKey is RZBIQJDAPAENNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O5S/c1-25-16-7-6-15(20-18(22)12-8-9-26-11-12)10-17(16)27(23,24)21-14-4-2-13(19)3-5-14/h2-11,21H,1H3,(H,20,22).
What are the key properties of N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide?
N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide has a molecular weight of 451.30 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]furan-3-carboxamide is sourced from PubChem (CID 25348399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).