4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole

C14H10F2N4 — CID 159656311

IUPAC4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
SMILESCc1c(F)c2c3c(c(C)c(F)c2c2c1=NCN=2)=NCN=3
InChIInChI=1S/C14H10F2N4/c1-5-9(15)7-8(13-11(5)17-3-19-13)10(16)6(2)12-14(7)20-4-18-12/h3-4H2,1-2H3
InChIKeyMSFLYBHQRZYUFO-UHFFFAOYSA-N
MW272.26 g/mol
LogP0.16
Rot. Bonds

About 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole

4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole (PubChem CID 159656311) has the molecular formula C14H10F2N4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole.

Molecular Properties

Compound Name4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
PubChem CID159656311
Molecular FormulaC14H10F2N4
Molecular Weight272.26 g/mol
Exact Mass272.09
IUPAC Name4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
SMILESCc1c(F)c2c3c(c(C)c(F)c2c2c1=NCN=2)=NCN=3
InChIInChI=1S/C14H10F2N4/c1-5-9(15)7-8(13-11(5)17-3-19-13)10(16)6(2)12-14(7)20-4-18-12/h3-4H2,1-2H3
InChIKeyMSFLYBHQRZYUFO-UHFFFAOYSA-N
XLogP0.16
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole 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

4,9-Difluoro-2,2,5,7,7,10-hexamethylbenzimidazolo[5,4-e]benzimidazole
CID 117673259
5,6-Difluoro-2,2,4,7-tetramethylbenzimidazole
CID 117708794
5,10-Ditert-butyl-4,9-difluoro-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
CID 134451232
4,5-difluoro-1-N,2-N,3,6-tetramethylcyclohexa-3,5-diene-1,2-diimine
CID 153668949
4,8-difluoro-2-N,5-N,3,7-tetramethylnaphthalene-1,2,5,6-tetraimine
CID 157899188
5,9-difluoro-6-N,4,8-trimethyl-2H-benzo[e]benzimidazole-6,7-diimine
CID 160228962
4,8-difluoro-1-N,5-N,3,7-tetramethylnaphthalene-1,2,5,6-tetraimine
CID 160611567
Methane;2,2,5,6-tetrafluoro-4,7-dimethylbenzimidazole
CID 160947057
4,9-Difluoro-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
CID 163938167
4,9-Difluoro-5-methyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazol-10-amine
CID 164053607
4,5,6,7-tetramethyl-2H-benzimidazole
CID 21034549
4,5,9,10-Tetramethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
CID 117708808

Frequently Asked Questions

What is the IUPAC name of 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The IUPAC name of 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole (CID 159656311) is 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole.
What is the SMILES notation for 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The canonical SMILES for 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole is Cc1c(F)c2c3c(c(C)c(F)c2c2c1=NCN=2)=NCN=3.
What is the InChIKey of 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The InChIKey is MSFLYBHQRZYUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N4/c1-5-9(15)7-8(13-11(5)17-3-19-13)10(16)6(2)12-14(7)20-4-18-12/h3-4H2,1-2H3.
What are the key properties of 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole has a molecular weight of 272.26 g/mol, XLogP of 0.16, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,9-difluoro-5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole is sourced from PubChem (CID 159656311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).