2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide

C18H12Cl2N4O2 — CID 13341093

IUPAC2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide
SMILESO=C(NC(=O)c1ccccc1Cl)Nc1cnc(-c2ccc(Cl)cc2)cn1
InChIInChI=1S/C18H12Cl2N4O2/c19-12-7-5-11(6-8-12)15-9-22-16(10-21-15)23-18(26)24-17(25)13-3-1-2-4-14(13)20/h1-10H,(H2,22,23,24,25,26)
InChIKeySJGIRTBZIINERY-UHFFFAOYSA-N
MW387.23 g/mol
LogP4.41
Rot. Bonds3

About 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide

2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide (PubChem CID 13341093) has the molecular formula C18H12Cl2N4O2 and a molecular weight of 387.23 g/mol. Its IUPAC name is 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide
PubChem CID13341093
Molecular FormulaC18H12Cl2N4O2
Molecular Weight387.23 g/mol
Exact Mass386.03
IUPAC Name2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide
SMILESO=C(NC(=O)c1ccccc1Cl)Nc1cnc(-c2ccc(Cl)cc2)cn1
InChIInChI=1S/C18H12Cl2N4O2/c19-12-7-5-11(6-8-12)15-9-22-16(10-21-15)23-18(26)24-17(25)13-3-1-2-4-14(13)20/h1-10H,(H2,22,23,24,25,26)
InChIKeySJGIRTBZIINERY-UHFFFAOYSA-N
XLogP4.41
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.23
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(5-nitropyrazin-2-yl)carbamoyl]benzamide
CID 20567047
2-bromo-N-[[5-[4-(trifluoromethyl)phenyl]pyrazin-2-yl]carbamoyl]benzamide
CID 20567036
N-[[5-(4-bromophenyl)-6-chloropyrazin-2-yl]carbamoyl]-2-chlorobenzamide
CID 13341092
2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
CID 23345083
2-chloro-N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide
CID 881777
2-chloro-N-[[5-(4-ethylphenyl)-6-methylpyrazin-2-yl]carbamoyl]benzamide
CID 13341085
2,6-dichloro-N-[(5-chloropyrazin-2-yl)carbamoyl]benzamide
CID 21313073
2-chloro-N-[(4,5-dichlorothiophen-2-yl)carbamoyl]benzamide
CID 14600661
2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide
CID 113012299
2-chloro-N-isoquinolin-3-ylbenzamide
CID 5237288
2-chloro-N-[[3-chloro-4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]carbamoyl]benzamide
CID 70629375
2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide
CID 20546757

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide?
The IUPAC name of 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide (CID 13341093) is 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide.
What is the SMILES notation for 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide?
The canonical SMILES for 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide is O=C(NC(=O)c1ccccc1Cl)Nc1cnc(-c2ccc(Cl)cc2)cn1.
What is the InChIKey of 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide?
The InChIKey is SJGIRTBZIINERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2N4O2/c19-12-7-5-11(6-8-12)15-9-22-16(10-21-15)23-18(26)24-17(25)13-3-1-2-4-14(13)20/h1-10H,(H2,22,23,24,25,26).
What are the key properties of 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide?
2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide has a molecular weight of 387.23 g/mol, XLogP of 4.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide is sourced from PubChem (CID 13341093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).