N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide

C19H15ClN2O4S — CID 39344855

IUPACN-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1NS(=O)(=O)/C=C/c1ccccc1)c1ccco1
InChIInChI=1S/C19H15ClN2O4S/c20-15-8-9-16(17(13-15)21-19(23)18-7-4-11-26-18)22-27(24,25)12-10-14-5-2-1-3-6-14/h1-13,22H,(H,21,23)/b12-10+
InChIKeyKXCRFMSSENKWJT-ZRDIBKRKSA-N
MW402.86 g/mol
LogP4.60
Rot. Bonds6

About N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide

N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide (PubChem CID 39344855) has the molecular formula C19H15ClN2O4S and a molecular weight of 402.86 g/mol. Its IUPAC name is N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide
PubChem CID39344855
Molecular FormulaC19H15ClN2O4S
Molecular Weight402.86 g/mol
Exact Mass402.04
IUPAC NameN-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1NS(=O)(=O)/C=C/c1ccccc1)c1ccco1
InChIInChI=1S/C19H15ClN2O4S/c20-15-8-9-16(17(13-15)21-19(23)18-7-4-11-26-18)22-27(24,25)12-10-14-5-2-1-3-6-14/h1-13,22H,(H,21,23)/b12-10+
InChIKeyKXCRFMSSENKWJT-ZRDIBKRKSA-N
XLogP4.60
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.86
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-chloro-2-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]furan-2-carboxamide
CID 55811858
N-[2-[(2-bromophenyl)sulfonylamino]-5-chlorophenyl]furan-2-carboxamide
CID 39344896
N-(2,4-dichlorophenyl)furan-2-carboxamide
CID 3105425
5-chloro-2-(furan-2-carbonylamino)benzoic acid
CID 16777457
N-[4-[[[(E)-2-phenylethenyl]sulfonylamino]methyl]phenyl]furan-2-carboxamide
CID 31112019
N-[5-chloro-2-[(1,3-dioxoisoindol-5-yl)sulfonylamino]phenyl]furan-2-carboxamide
CID 56582600
N-[5-chloro-2-[(4-oxo-4-phenylbutanoyl)amino]phenyl]furan-2-carboxamide
CID 55932482
N-(4-chloro-2-nitrophenyl)-2-phenylethenesulfonamide
CID 73447777
N-[5-chloro-2-[(3-fluorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 55645358
1-(benzenesulfonyl)-N-[4-chloro-2-(furan-2-carbonylamino)phenyl]piperidine-4-carboxamide
CID 55811797
N-[5-chloro-2-[[(2S)-2-methylsulfanylpropanoyl]amino]phenyl]furan-2-carboxamide
CID 94660299
N-[2-[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]-5-chlorophenyl]furan-2-carboxamide
CID 55645244

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide (CID 39344855) is N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide is O=C(Nc1cc(Cl)ccc1NS(=O)(=O)/C=C/c1ccccc1)c1ccco1.
What is the InChIKey of N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide?
The InChIKey is KXCRFMSSENKWJT-ZRDIBKRKSA-N. The full InChI is InChI=1S/C19H15ClN2O4S/c20-15-8-9-16(17(13-15)21-19(23)18-7-4-11-26-18)22-27(24,25)12-10-14-5-2-1-3-6-14/h1-13,22H,(H,21,23)/b12-10+.
What are the key properties of N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide?
N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide has a molecular weight of 402.86 g/mol, XLogP of 4.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 39344855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).