(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone

C16H12Cl3N3O — CID 13189163

IUPAC(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone
SMILESO=C(c1ccc(Cl)cc1)N1CCN=C1Nc1cccc(Cl)c1Cl
InChIInChI=1S/C16H12Cl3N3O/c17-11-6-4-10(5-7-11)15(23)22-9-8-20-16(22)21-13-3-1-2-12(18)14(13)19/h1-7H,8-9H2,(H,20,21)
InChIKeyGCINRLFINZQWPS-UHFFFAOYSA-N
MW368.65 g/mol
LogP4.57
Rot. Bonds2

About (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone

(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone (PubChem CID 13189163) has the molecular formula C16H12Cl3N3O and a molecular weight of 368.65 g/mol. Its IUPAC name is (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone
PubChem CID13189163
Molecular FormulaC16H12Cl3N3O
Molecular Weight368.65 g/mol
Exact Mass367.00
IUPAC Name(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone
SMILESO=C(c1ccc(Cl)cc1)N1CCN=C1Nc1cccc(Cl)c1Cl
InChIInChI=1S/C16H12Cl3N3O/c17-11-6-4-10(5-7-11)15(23)22-9-8-20-16(22)21-13-3-1-2-12(18)14(13)19/h1-7H,8-9H2,(H,20,21)
InChIKeyGCINRLFINZQWPS-UHFFFAOYSA-N
XLogP4.57
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.65
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone?
The IUPAC name of (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone (CID 13189163) is (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone.
What is the SMILES notation for (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone?
The canonical SMILES for (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone is O=C(c1ccc(Cl)cc1)N1CCN=C1Nc1cccc(Cl)c1Cl.
What is the InChIKey of (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone?
The InChIKey is GCINRLFINZQWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl3N3O/c17-11-6-4-10(5-7-11)15(23)22-9-8-20-16(22)21-13-3-1-2-12(18)14(13)19/h1-7H,8-9H2,(H,20,21).
What are the key properties of (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone?
(4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone has a molecular weight of 368.65 g/mol, XLogP of 4.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[2-(2,3-dichloroanilino)-4,5-dihydroimidazol-1-yl]methanone is sourced from PubChem (CID 13189163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).