2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

C17H18Cl2N2O4S — CID 55371526

IUPAC2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCc1ccc(C(C)NC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)o1
InChIInChI=1S/C17H18Cl2N2O4S/c1-9-3-6-15(25-9)10(2)20-17(22)12-7-16(14(19)8-13(12)18)26(23,24)21-11-4-5-11/h3,6-8,10-11,21H,4-5H2,1-2H3,(H,20,22)
InChIKeyBHGZXZYFOGFWOK-UHFFFAOYSA-N
MW417.31 g/mol
LogP3.83
Rot. Bonds6

About 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (PubChem CID 55371526) has the molecular formula C17H18Cl2N2O4S and a molecular weight of 417.31 g/mol. Its IUPAC name is 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
PubChem CID55371526
Molecular FormulaC17H18Cl2N2O4S
Molecular Weight417.31 g/mol
Exact Mass416.04
IUPAC Name2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCc1ccc(C(C)NC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)o1
InChIInChI=1S/C17H18Cl2N2O4S/c1-9-3-6-15(25-9)10(2)20-17(22)12-7-16(14(19)8-13(12)18)26(23,24)21-11-4-5-11/h3,6-8,10-11,21H,4-5H2,1-2H3,(H,20,22)
InChIKeyBHGZXZYFOGFWOK-UHFFFAOYSA-N
XLogP3.83
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.31
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]benzamide
CID 55579835
N-(4-acetamidophenyl)-2,4-dichloro-5-(cyclopropylsulfamoyl)benzamide
CID 19257569
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 5295477
propan-2-yl 2,4-dichloro-5-(cyclopropylsulfamoyl)benzoate
CID 46574592
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(3-fluoro-4-methylphenyl)benzamide
CID 30866994
2-chloro-N-[1-(5-methylfuran-2-yl)ethyl]-5-methylsulfanylbenzamide
CID 47110574
propan-2-yl 2-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]acetate
CID 56543666
2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 51187743
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-pentylbenzamide
CID 46665692
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-4-chloro-3-(cyclopropylsulfamoyl)benzamide
CID 9368958
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(3,4-dimethoxyphenyl)benzamide
CID 19258290
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 19257437

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The IUPAC name of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (CID 55371526) is 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.
What is the SMILES notation for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The canonical SMILES for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is Cc1ccc(C(C)NC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)o1.
What is the InChIKey of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The InChIKey is BHGZXZYFOGFWOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O4S/c1-9-3-6-15(25-9)10(2)20-17(22)12-7-16(14(19)8-13(12)18)26(23,24)21-11-4-5-11/h3,6-8,10-11,21H,4-5H2,1-2H3,(H,20,22).
What are the key properties of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide has a molecular weight of 417.31 g/mol, XLogP of 3.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is sourced from PubChem (CID 55371526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).