N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide

C19H18N2O4S — CID 1112090

IUPACN-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccco2)cc1
InChIInChI=1S/C19H18N2O4S/c1-14-8-10-16(11-9-14)26(23,24)21-18-7-3-2-6-17(18)19(22)20-13-15-5-4-12-25-15/h2-12,21H,13H2,1H3,(H,20,22)
InChIKeyVEVACJVQXGPSQB-UHFFFAOYSA-N
MW370.43 g/mol
LogP3.32
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide

N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 1112090) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID1112090
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC NameN-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccco2)cc1
InChIInChI=1S/C19H18N2O4S/c1-14-8-10-16(11-9-14)26(23,24)21-18-7-3-2-6-17(18)19(22)20-13-15-5-4-12-25-15/h2-12,21H,13H2,1H3,(H,20,22)
InChIKeyVEVACJVQXGPSQB-UHFFFAOYSA-N
XLogP3.32
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide (CID 1112090) is N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide is Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccco2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is VEVACJVQXGPSQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c1-14-8-10-16(11-9-14)26(23,24)21-18-7-3-2-6-17(18)19(22)20-13-15-5-4-12-25-15/h2-12,21H,13H2,1H3,(H,20,22).
What are the key properties of N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 370.43 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 1112090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).