N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

C19H23N3O3S — CID 53372871

IUPACN-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCCCCc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C19H23N3O3S/c1-2-3-4-15-5-7-16(8-6-15)21-26(24,25)18-11-9-17(10-12-18)22-14-13-20-19(22)23/h5-12,21H,2-4,13-14H2,1H3,(H,20,23)
InChIKeyIHTLMJFBQAKDKC-UHFFFAOYSA-N
MW373.48 g/mol
LogP3.36
Rot. Bonds7

About N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (PubChem CID 53372871) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
PubChem CID53372871
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCCCCc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C19H23N3O3S/c1-2-3-4-15-5-7-16(8-6-15)21-26(24,25)18-11-9-17(10-12-18)22-14-13-20-19(22)23/h5-12,21H,2-4,13-14H2,1H3,(H,20,23)
InChIKeyIHTLMJFBQAKDKC-UHFFFAOYSA-N
XLogP3.36
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (CID 53372871) is N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is CCCCc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1.
What is the InChIKey of N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The InChIKey is IHTLMJFBQAKDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-2-3-4-15-5-7-16(8-6-15)21-26(24,25)18-11-9-17(10-12-18)22-14-13-20-19(22)23/h5-12,21H,2-4,13-14H2,1H3,(H,20,23).
What are the key properties of N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide has a molecular weight of 373.48 g/mol, XLogP of 3.36, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 53372871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).