(3-chlorophenyl)sulfonylurea

C7H7ClN2O3S — CID 117060605

IUPAC(3-chlorophenyl)sulfonylurea
SMILESNC(=O)NS(=O)(=O)c1cccc(Cl)c1
InChIInChI=1S/C7H7ClN2O3S/c8-5-2-1-3-6(4-5)14(12,13)10-7(9)11/h1-4H,(H3,9,10,11)
InChIKeyFFKZMFGRJIGUJX-UHFFFAOYSA-N
MW234.66 g/mol
LogP0.70
Rot. Bonds2

About (3-chlorophenyl)sulfonylurea

(3-chlorophenyl)sulfonylurea (PubChem CID 117060605) has the molecular formula C7H7ClN2O3S and a molecular weight of 234.66 g/mol. Its IUPAC name is (3-chlorophenyl)sulfonylurea.

Molecular Properties

Compound Name(3-chlorophenyl)sulfonylurea
PubChem CID117060605
Molecular FormulaC7H7ClN2O3S
Molecular Weight234.66 g/mol
Exact Mass233.99
IUPAC Name(3-chlorophenyl)sulfonylurea
SMILESNC(=O)NS(=O)(=O)c1cccc(Cl)c1
InChIInChI=1S/C7H7ClN2O3S/c8-5-2-1-3-6(4-5)14(12,13)10-7(9)11/h1-4H,(H3,9,10,11)
InChIKeyFFKZMFGRJIGUJX-UHFFFAOYSA-N
XLogP0.70
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.66
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-bis[(3-chlorophenyl)sulfonyl]urea
CID 155928665
[(3-chlorophenyl)-methylidene-oxo-λ6-sulfanyl]urea
CID 177035624
3-chloro-N-(3-chlorophenyl)sulfonylbenzenesulfonamide
CID 18537457
N-(3-chlorophenyl)sulfonyl-2-methylpropanamide
CID 47269833
N-(3-chlorophenyl)sulfonyl-2,2-dimethylpropanamide
CID 47269831
3-chlorobenzenesulfonohydrazide
CID 12924057
(3-methylphenyl)sulfonylurea
CID 46224904
[(3-chlorophenyl)sulfonylamino]thiourea
CID 65214631
N-(3-chlorophenyl)sulfonyl-4-methylpentanamide
CID 47233055
1-(3-chlorophenyl)sulfonyl-3-(2-sulfanylethyl)urea
CID 44587907
(2R)-2-[(3-chlorophenyl)sulfonylamino]-2-phenylacetamide
CID 51472168
1-(3-chlorophenyl)sulfonyl-3-[2-[2-[(3-chlorophenyl)sulfonylcarbamoylamino]ethoxy]ethyl]urea
CID 44587806

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)sulfonylurea?
The IUPAC name of (3-chlorophenyl)sulfonylurea (CID 117060605) is (3-chlorophenyl)sulfonylurea.
What is the SMILES notation for (3-chlorophenyl)sulfonylurea?
The canonical SMILES for (3-chlorophenyl)sulfonylurea is NC(=O)NS(=O)(=O)c1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)sulfonylurea?
The InChIKey is FFKZMFGRJIGUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O3S/c8-5-2-1-3-6(4-5)14(12,13)10-7(9)11/h1-4H,(H3,9,10,11).
What are the key properties of (3-chlorophenyl)sulfonylurea?
(3-chlorophenyl)sulfonylurea has a molecular weight of 234.66 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)sulfonylurea is sourced from PubChem (CID 117060605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).