1,3-bis(benzenesulfonyl)imidazolidine

C15H16N2O4S2 — CID 1354022

IUPAC1,3-bis(benzenesulfonyl)imidazolidine
SMILESO=S(=O)(c1ccccc1)N1CCN(S(=O)(=O)c2ccccc2)C1
InChIInChI=1S/C15H16N2O4S2/c18-22(19,14-7-3-1-4-8-14)16-11-12-17(13-16)23(20,21)15-9-5-2-6-10-15/h1-10H,11-13H2
InChIKeyKNLXCRJELGBUSX-UHFFFAOYSA-N
MW352.44 g/mol
LogP1.34
Rot. Bonds4

About 1,3-bis(benzenesulfonyl)imidazolidine

1,3-bis(benzenesulfonyl)imidazolidine (PubChem CID 1354022) has the molecular formula C15H16N2O4S2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 1,3-bis(benzenesulfonyl)imidazolidine.

Molecular Properties

Compound Name1,3-bis(benzenesulfonyl)imidazolidine
PubChem CID1354022
Molecular FormulaC15H16N2O4S2
Molecular Weight352.44 g/mol
Exact Mass352.06
IUPAC Name1,3-bis(benzenesulfonyl)imidazolidine
SMILESO=S(=O)(c1ccccc1)N1CCN(S(=O)(=O)c2ccccc2)C1
InChIInChI=1S/C15H16N2O4S2/c18-22(19,14-7-3-1-4-8-14)16-11-12-17(13-16)23(20,21)15-9-5-2-6-10-15/h1-10H,11-13H2
InChIKeyKNLXCRJELGBUSX-UHFFFAOYSA-N
XLogP1.34
TPSA74.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-bis(benzenesulfonyl)-1,3-diazocane
CID 13382390
4-[4-(benzenesulfonyl)piperazin-1-yl]sulfonylaniline
CID 2052130
3-(benzenesulfonyl)-3-azabicyclo[3.1.0]hexane
CID 77427931
1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-methylpropan-1-one
CID 59279112
1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazine
CID 8743546
4-(benzenesulfonyl)piperazine-1-carbothioamide
CID 2052028
1-(benzenesulfonyl)-4-propylsulfonylpiperazine
CID 719624
4-(benzenesulfonyl)morpholine;ethane
CID 143200179
1-(benzenesulfonyl)-4-methylpiperidine
CID 761422
1-(benzenesulfonyl)-4,4-dimethylpiperidine
CID 58376409
4-(benzenesulfonyl)-N,N-dimethyl-1,4-diazepane-1-sulfonamide
CID 110799693
1-(benzenesulfonyl)-4-(4-fluorophenyl)piperazine
CID 779709

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(benzenesulfonyl)imidazolidine?
The IUPAC name of 1,3-bis(benzenesulfonyl)imidazolidine (CID 1354022) is 1,3-bis(benzenesulfonyl)imidazolidine.
What is the SMILES notation for 1,3-bis(benzenesulfonyl)imidazolidine?
The canonical SMILES for 1,3-bis(benzenesulfonyl)imidazolidine is O=S(=O)(c1ccccc1)N1CCN(S(=O)(=O)c2ccccc2)C1.
What is the InChIKey of 1,3-bis(benzenesulfonyl)imidazolidine?
The InChIKey is KNLXCRJELGBUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S2/c18-22(19,14-7-3-1-4-8-14)16-11-12-17(13-16)23(20,21)15-9-5-2-6-10-15/h1-10H,11-13H2.
What are the key properties of 1,3-bis(benzenesulfonyl)imidazolidine?
1,3-bis(benzenesulfonyl)imidazolidine has a molecular weight of 352.44 g/mol, XLogP of 1.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(benzenesulfonyl)imidazolidine is sourced from PubChem (CID 1354022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).