1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one

C16H12Cl2N4O — CID 51029662

IUPAC1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one
SMILESO=C1NCC(c2cccc(Cl)c2Cl)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C16H12Cl2N4O/c17-11-3-1-2-10(15(11)18)14-7-19-16(23)22(14)9-4-5-12-13(6-9)21-8-20-12/h1-6,8,14H,7H2,(H,19,23)(H,20,21)
InChIKeyYVAVPYJCIDFSNA-UHFFFAOYSA-N
MW347.21 g/mol
LogP4.14
Rot. Bonds2

About 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one

1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one (PubChem CID 51029662) has the molecular formula C16H12Cl2N4O and a molecular weight of 347.21 g/mol. Its IUPAC name is 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one
PubChem CID51029662
Molecular FormulaC16H12Cl2N4O
Molecular Weight347.21 g/mol
Exact Mass346.04
IUPAC Name1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one
SMILESO=C1NCC(c2cccc(Cl)c2Cl)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C16H12Cl2N4O/c17-11-3-1-2-10(15(11)18)14-7-19-16(23)22(14)9-4-5-12-13(6-9)21-8-20-12/h1-6,8,14H,7H2,(H,19,23)(H,20,21)
InChIKeyYVAVPYJCIDFSNA-UHFFFAOYSA-N
XLogP4.14
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.21
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one?
The IUPAC name of 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one (CID 51029662) is 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one?
The canonical SMILES for 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one is O=C1NCC(c2cccc(Cl)c2Cl)N1c1ccc2nc[nH]c2c1.
What is the InChIKey of 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one?
The InChIKey is YVAVPYJCIDFSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N4O/c17-11-3-1-2-10(15(11)18)14-7-19-16(23)22(14)9-4-5-12-13(6-9)21-8-20-12/h1-6,8,14H,7H2,(H,19,23)(H,20,21).
What are the key properties of 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one?
1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one has a molecular weight of 347.21 g/mol, XLogP of 4.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-benzimidazol-5-yl)-5-(2,3-dichlorophenyl)imidazolidin-2-one is sourced from PubChem (CID 51029662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).