4-bromo-N-(4-bromo-2-chlorophenyl)benzamide

C13H8Br2ClNO — CID 7924398

IUPAC4-bromo-N-(4-bromo-2-chlorophenyl)benzamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1ccc(Br)cc1
InChIInChI=1S/C13H8Br2ClNO/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(15)7-11(12)16/h1-7H,(H,17,18)
InChIKeyGDYKTJFWVDHHSB-UHFFFAOYSA-N
MW389.47 g/mol
LogP5.12
Rot. Bonds2

About 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide

4-bromo-N-(4-bromo-2-chlorophenyl)benzamide (PubChem CID 7924398) has the molecular formula C13H8Br2ClNO and a molecular weight of 389.47 g/mol. Its IUPAC name is 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(4-bromo-2-chlorophenyl)benzamide
PubChem CID7924398
Molecular FormulaC13H8Br2ClNO
Molecular Weight389.47 g/mol
Exact Mass386.87
IUPAC Name4-bromo-N-(4-bromo-2-chlorophenyl)benzamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1ccc(Br)cc1
InChIInChI=1S/C13H8Br2ClNO/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(15)7-11(12)16/h1-7H,(H,17,18)
InChIKeyGDYKTJFWVDHHSB-UHFFFAOYSA-N
XLogP5.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.47
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 64786775
4-bromo-N-(2-chloro-4-iodophenyl)benzamide
CID 47183104
methyl 4-[(4-bromo-2-chlorophenyl)carbamoyl]benzoate
CID 26239580
4-bromo-N-(4-bromo-2-iodophenyl)benzamide
CID 3934518
4-bromo-N-[3-(4-bromo-2-chloroanilino)-3-oxopropyl]benzamide
CID 26239604
N-(4-bromo-2-chlorophenyl)-4-chloro-3-methylsulfonylbenzamide
CID 26239627
N-(4-bromo-2-chlorophenyl)-4-propoxybenzamide
CID 8863043
[4-[(4-bromo-2-chlorophenyl)carbamoyl]phenyl] propanoate
CID 2993801
4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide
CID 113445906
N-(4-bromo-2-chlorophenyl)-2,1,3-benzothiadiazole-5-carboxamide
CID 17313577
N-[(4-bromo-2-chlorophenyl)carbamothioyl]-4-iodobenzamide
CID 17115477
4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 763593

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide?
The IUPAC name of 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide (CID 7924398) is 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide.
What is the SMILES notation for 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide?
The canonical SMILES for 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide is O=C(Nc1ccc(Br)cc1Cl)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide?
The InChIKey is GDYKTJFWVDHHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br2ClNO/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(15)7-11(12)16/h1-7H,(H,17,18).
What are the key properties of 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide?
4-bromo-N-(4-bromo-2-chlorophenyl)benzamide has a molecular weight of 389.47 g/mol, XLogP of 5.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(4-bromo-2-chlorophenyl)benzamide is sourced from PubChem (CID 7924398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).