(2-bromo-6-chloro-4-fluorophenyl)urea

C7H5BrClFN2O — CID 103578342

IUPAC(2-bromo-6-chloro-4-fluorophenyl)urea
SMILESNC(=O)Nc1c(Cl)cc(F)cc1Br
InChIInChI=1S/C7H5BrClFN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyWHXZVNCHBISCHI-UHFFFAOYSA-N
MW267.49 g/mol
LogP2.73
Rot. Bonds1

About (2-bromo-6-chloro-4-fluorophenyl)urea

(2-bromo-6-chloro-4-fluorophenyl)urea (PubChem CID 103578342) has the molecular formula C7H5BrClFN2O and a molecular weight of 267.49 g/mol. Its IUPAC name is (2-bromo-6-chloro-4-fluorophenyl)urea.

Molecular Properties

Compound Name(2-bromo-6-chloro-4-fluorophenyl)urea
PubChem CID103578342
Molecular FormulaC7H5BrClFN2O
Molecular Weight267.49 g/mol
Exact Mass265.93
IUPAC Name(2-bromo-6-chloro-4-fluorophenyl)urea
SMILESNC(=O)Nc1c(Cl)cc(F)cc1Br
InChIInChI=1S/C7H5BrClFN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyWHXZVNCHBISCHI-UHFFFAOYSA-N
XLogP2.73
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.49
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze (2-bromo-6-chloro-4-fluorophenyl)urea 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-(3-Bromophenyl)-3-(2-chloro-4,5-difluorophenyl)urea
CID 4526979
N-(4-bromo-2-chloro-6-fluorophenyl)acetamide
CID 19810890
1-(4-Bromo-2-chloro-6-fluorophenyl)-3-methylurea
CID 21161250
1-(4-Bromo-2-chloro-6-fluorophenyl)-3-(diaminomethylidene)-1-methylurea
CID 21161259
1-(4-Bromo-2-chloro-6-fluorophenyl)-3-(diaminomethylidene)urea
CID 21161410
1-(2-Bromo-6-chloro-4-fluorophenyl)-1-methylguanidine
CID 57046931
(2-Bromo-5-chloro-4-fluorophenyl)urea
CID 68537321
(2-Bromo-4-chloro-6-fluorophenyl)carbamic acid
CID 68918193
(2,6-Dichloro-4-fluorophenyl)urea
CID 83079264
methyl N-(2-bromo-6-chloro-4-fluorophenyl)carbamate
CID 107610842
[N'-(2-bromo-6-chloro-4-fluorophenyl)carbamimidoyl]urea
CID 136121173
(2-Bromo-6-chloro-4-fluorophenyl)carbamic acid
CID 138685611

Frequently Asked Questions

What is the IUPAC name of (2-bromo-6-chloro-4-fluorophenyl)urea?
The IUPAC name of (2-bromo-6-chloro-4-fluorophenyl)urea (CID 103578342) is (2-bromo-6-chloro-4-fluorophenyl)urea.
What is the SMILES notation for (2-bromo-6-chloro-4-fluorophenyl)urea?
The canonical SMILES for (2-bromo-6-chloro-4-fluorophenyl)urea is NC(=O)Nc1c(Cl)cc(F)cc1Br.
What is the InChIKey of (2-bromo-6-chloro-4-fluorophenyl)urea?
The InChIKey is WHXZVNCHBISCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrClFN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13).
What are the key properties of (2-bromo-6-chloro-4-fluorophenyl)urea?
(2-bromo-6-chloro-4-fluorophenyl)urea has a molecular weight of 267.49 g/mol, XLogP of 2.73, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-6-chloro-4-fluorophenyl)urea is sourced from PubChem (CID 103578342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).