1-benzhydrylimidazole;hydrobromide

C16H15BrN2 — CID 174865219

IUPAC1-benzhydrylimidazole;hydrobromide
SMILESBr.c1ccc(C(c2ccccc2)n2ccnc2)cc1
InChIInChI=1S/C16H14N2.BrH/c1-3-7-14(8-4-1)16(18-12-11-17-13-18)15-9-5-2-6-10-15;/h1-13,16H;1H
InChIKeyVAJWWDBXKORMHM-UHFFFAOYSA-N
MW315.21 g/mol
LogP4.10
Rot. Bonds3

About 1-benzhydrylimidazole;hydrobromide

1-benzhydrylimidazole;hydrobromide (PubChem CID 174865219) has the molecular formula C16H15BrN2 and a molecular weight of 315.21 g/mol. Its IUPAC name is 1-benzhydrylimidazole;hydrobromide.

Molecular Properties

Compound Name1-benzhydrylimidazole;hydrobromide
PubChem CID174865219
Molecular FormulaC16H15BrN2
Molecular Weight315.21 g/mol
Exact Mass314.04
IUPAC Name1-benzhydrylimidazole;hydrobromide
SMILESBr.c1ccc(C(c2ccccc2)n2ccnc2)cc1
InChIInChI=1S/C16H14N2.BrH/c1-3-7-14(8-4-1)16(18-12-11-17-13-18)15-9-5-2-6-10-15;/h1-13,16H;1H
InChIKeyVAJWWDBXKORMHM-UHFFFAOYSA-N
XLogP4.10
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.21
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-benzhydrylimidazole;hydrobromide 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

1-[4-[imidazol-1-yl(phenyl)methyl]phenyl]imidazole
CID 14594096
5-[imidazol-1-yl(phenyl)methyl]-2,3-dihydro-1H-benzimidazole
CID 174253114
6-[imidazol-1-yl(phenyl)methyl]-2,3-dimethylquinoxaline
CID 19875835
[imidazol-1-yl(phenyl)methyl]hydrazine
CID 102225378
6-[imidazol-1-yl(phenyl)methyl]-3H-1,3-benzothiazol-2-one
CID 58828708
ethyl 4-[4-[imidazol-1-yl(phenyl)methyl]phenoxy]butanoate
CID 139612850
6-[imidazol-1-yl(phenyl)methyl]quinoline sulfate
CID 19967120
1-[(R)-(4-chlorophenyl)-(4-pyrrol-1-ylphenyl)methyl]imidazole
CID 57395780
1-[(5-chloro-1-benzofuran-2-yl)-phenylmethyl]imidazole
CID 21277774
5-[imidazol-1-yl(phenyl)methyl]-2-methylsulfanyl-4-phenylpyrimidine
CID 508517
methanesulfonic acid;1-(1-phenylethyl)imidazole
CID 174969600
1-ethyl-6-[imidazol-1-yl(phenyl)methyl]quinoxalin-2-one
CID 141114210

Frequently Asked Questions

What is the IUPAC name of 1-benzhydrylimidazole;hydrobromide?
The IUPAC name of 1-benzhydrylimidazole;hydrobromide (CID 174865219) is 1-benzhydrylimidazole;hydrobromide.
What is the SMILES notation for 1-benzhydrylimidazole;hydrobromide?
The canonical SMILES for 1-benzhydrylimidazole;hydrobromide is Br.c1ccc(C(c2ccccc2)n2ccnc2)cc1.
What is the InChIKey of 1-benzhydrylimidazole;hydrobromide?
The InChIKey is VAJWWDBXKORMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2.BrH/c1-3-7-14(8-4-1)16(18-12-11-17-13-18)15-9-5-2-6-10-15;/h1-13,16H;1H.
What are the key properties of 1-benzhydrylimidazole;hydrobromide?
1-benzhydrylimidazole;hydrobromide has a molecular weight of 315.21 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydrylimidazole;hydrobromide is sourced from PubChem (CID 174865219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).