CID 167493911

C26H34N2O5S2 — CID 167493911

IUPAC—
SMILESCC(C)S(=O)(=O)c1cccc(C(=O)N2CC3(CCC4(CC4)CC3)c3cc(NS(C)(=O)=O)ccc32)c1.[H][H]
InChIInChI=1S/C26H32N2O5S2.H2/c1-18(2)35(32,33)21-6-4-5-19(15-21)24(29)28-17-26(13-11-25(9-10-25)12-14-26)22-16-20(7-8-23(22)28)27-34(3,30)31;/h4-8,15-16,18,27H,9-14,17H2,1-3H3;1H
InChIKeyGGLCWLWURVOBEG-UHFFFAOYSA-N
MW518.70 g/mol
LogP4.74
Rot. Bonds5

About CID 167493911

CID 167493911 (PubChem CID 167493911) has the molecular formula C26H34N2O5S2 and a molecular weight of 518.70 g/mol.

Molecular Properties

Compound NameCID 167493911
PubChem CID167493911
Molecular FormulaC26H34N2O5S2
Molecular Weight518.70 g/mol
Exact Mass518.19
IUPAC Name—
SMILESCC(C)S(=O)(=O)c1cccc(C(=O)N2CC3(CCC4(CC4)CC3)c3cc(NS(C)(=O)=O)ccc32)c1.[H][H]
InChIInChI=1S/C26H32N2O5S2.H2/c1-18(2)35(32,33)21-6-4-5-19(15-21)24(29)28-17-26(13-11-25(9-10-25)12-14-26)22-16-20(7-8-23(22)28)27-34(3,30)31;/h4-8,15-16,18,27H,9-14,17H2,1-3H3;1H
InChIKeyGGLCWLWURVOBEG-UHFFFAOYSA-N
XLogP4.74
TPSA100.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500518.70
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 167493685
CID 167493685
CID 167493507
CID 167493507
CID 167493484
CID 167493484
N-(1-methylcyclobutyl)-3-(5$#8243;-(methylsulfonamido)dispiro[cyclopropane-1,1'-cyclohexane-4',3$#8243;-indoline]-1$#8243;-carbonyl)benzenesulfonamide
CID 168726719
N-(3-methyloxetan-3-yl)-3-(5$#8243;-(methylsulfonamido)dispiro[cyclopropane-1,1'-cyclohexane-4',3$#8243;-indoline]-1$#8243;-carbonyl)benzenesulfonamide
CID 167494174
CID 167493617
CID 167493617
3-[5-(methanesulfonamido)spiro[2H-indole-3,1'-cyclohexane]-1-carbonyl]-N-methyl-N-propan-2-ylbenzenesulfonamide
CID 167493926
N-(2-allylcyclopropyl)-3-(5$#8243;-(methylsulfonamido)dispiro[cyclopropane-1,1'-cyclohexane-4',3$#8243;-indoline]-1$#8243;-carbonyl)benzenesulfonamide
CID 167493689
CID 167494190
CID 167494190
N-tert-butyl-3-[5-(methanesulfonamido)spiro[2H-indole-3,4'-cyclopentene]-1-carbonyl]benzenesulfonamide
CID 168726745
N-(2,2-dimethyloxetan-3-yl)-3-[5-(methanesulfonamido)spiro[2H-indole-3,1'-cyclohexane]-1-carbonyl]benzenesulfonamide
CID 167493723
CID 167493724
CID 167493724

Frequently Asked Questions

What is the IUPAC name of CID 167493911?
The IUPAC name of CID 167493911 (CID 167493911) is not available.
What is the SMILES notation for CID 167493911?
The canonical SMILES for CID 167493911 is CC(C)S(=O)(=O)c1cccc(C(=O)N2CC3(CCC4(CC4)CC3)c3cc(NS(C)(=O)=O)ccc32)c1.[H][H].
What is the InChIKey of CID 167493911?
The InChIKey is GGLCWLWURVOBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N2O5S2.H2/c1-18(2)35(32,33)21-6-4-5-19(15-21)24(29)28-17-26(13-11-25(9-10-25)12-14-26)22-16-20(7-8-23(22)28)27-34(3,30)31;/h4-8,15-16,18,27H,9-14,17H2,1-3H3;1H.
What are the key properties of CID 167493911?
CID 167493911 has a molecular weight of 518.70 g/mol, XLogP of 4.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 167493911 is sourced from PubChem (CID 167493911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).