1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane

C10H14N2S — CID 123457333

IUPAC1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane
SMILESCS(C)(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C10H14N2S/c1-13(2,3)10-11-8-6-4-5-7-9(8)12-10/h4-7H,1-3H3,(H,11,12)
InChIKeyHNWSLKSGUFPITE-UHFFFAOYSA-N
MW194.30 g/mol
LogP2.62
Rot. Bonds1

About 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane

1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane (PubChem CID 123457333) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane.

Molecular Properties

Compound Name1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane
PubChem CID123457333
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane
SMILESCS(C)(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C10H14N2S/c1-13(2,3)10-11-8-6-4-5-7-9(8)12-10/h4-7H,1-3H3,(H,11,12)
InChIKeyHNWSLKSGUFPITE-UHFFFAOYSA-N
XLogP2.62
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethyl-1H-benzimidazole-2-sulfonamide
CID 23041875
2-methyl-1H-benzimidazole
CID 11984
55,56,57,58,59,60,61,62,63,64,65,66-dodecazatridecacyclo[49.3.1.12,5.16,10.111,14.115,19.120,23.124,28.129,32.133,37.138,41.142,46.147,50]hexahexaconta-1(55),2,4,6(65),7,9,11,13,15(63),16,18,20,22,24(61),25,27,29,31,33,35,37(59),38,40,42,44,46(57),47,49,51,53-triacontaene
CID 102362260
2-(2,4,6-trimethylphenyl)sulfonyl-1H-benzimidazole chloride
CID 21204339
CID 57351349
CID 57351349
2-[2-(1H-benzimidazol-2-yl)propan-2-yl]-1H-benzimidazole
CID 66628016
methanamine;2-methyl-1H-benzimidazole
CID 143453689
ethane;2-methyl-1H-benzimidazole;molecular hydrogen
CID 166167875
2-propan-2-yl-1H-benzimidazole
CID 22121
2-methylselanyl-1H-benzimidazole
CID 583074
1H-benzimidazole-2-thiolate;ethane;zinc
CID 159834857
N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846

Frequently Asked Questions

What is the IUPAC name of 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane?
The IUPAC name of 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane (CID 123457333) is 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane.
What is the SMILES notation for 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane?
The canonical SMILES for 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane is CS(C)(C)c1nc2ccccc2[nH]1.
What is the InChIKey of 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane?
The InChIKey is HNWSLKSGUFPITE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2S/c1-13(2,3)10-11-8-6-4-5-7-9(8)12-10/h4-7H,1-3H3,(H,11,12).
What are the key properties of 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane?
1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane has a molecular weight of 194.30 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane is sourced from PubChem (CID 123457333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).