(6-chloropyrazin-2-yl)-diphenylmethanol

C17H13ClN2O — CID 139402192

IUPAC(6-chloropyrazin-2-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)c1cncc(Cl)n1
InChIInChI=1S/C17H13ClN2O/c18-16-12-19-11-15(20-16)17(21,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,21H
InChIKeyLUNRGIGUQURNHH-UHFFFAOYSA-N
MW296.76 g/mol
LogP3.41
Rot. Bonds3

About (6-chloropyrazin-2-yl)-diphenylmethanol

(6-chloropyrazin-2-yl)-diphenylmethanol (PubChem CID 139402192) has the molecular formula C17H13ClN2O and a molecular weight of 296.76 g/mol. Its IUPAC name is (6-chloropyrazin-2-yl)-diphenylmethanol.

Molecular Properties

Compound Name(6-chloropyrazin-2-yl)-diphenylmethanol
PubChem CID139402192
Molecular FormulaC17H13ClN2O
Molecular Weight296.76 g/mol
Exact Mass296.07
IUPAC Name(6-chloropyrazin-2-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)c1cncc(Cl)n1
InChIInChI=1S/C17H13ClN2O/c18-16-12-19-11-15(20-16)17(21,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,21H
InChIKeyLUNRGIGUQURNHH-UHFFFAOYSA-N
XLogP3.41
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.76
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-chloropyrazin-2-yl)-diphenylmethanol?
The IUPAC name of (6-chloropyrazin-2-yl)-diphenylmethanol (CID 139402192) is (6-chloropyrazin-2-yl)-diphenylmethanol.
What is the SMILES notation for (6-chloropyrazin-2-yl)-diphenylmethanol?
The canonical SMILES for (6-chloropyrazin-2-yl)-diphenylmethanol is OC(c1ccccc1)(c1ccccc1)c1cncc(Cl)n1.
What is the InChIKey of (6-chloropyrazin-2-yl)-diphenylmethanol?
The InChIKey is LUNRGIGUQURNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O/c18-16-12-19-11-15(20-16)17(21,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,21H.
What are the key properties of (6-chloropyrazin-2-yl)-diphenylmethanol?
(6-chloropyrazin-2-yl)-diphenylmethanol has a molecular weight of 296.76 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloropyrazin-2-yl)-diphenylmethanol is sourced from PubChem (CID 139402192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).