N-(3-benzamidophenazin-2-yl)benzamide

C26H18N4O2 — CID 3547793

IUPACN-(3-benzamidophenazin-2-yl)benzamide
SMILESO=C(Nc1cc2nc3ccccc3nc2cc1NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H18N4O2/c31-25(17-9-3-1-4-10-17)29-23-15-21-22(28-20-14-8-7-13-19(20)27-21)16-24(23)30-26(32)18-11-5-2-6-12-18/h1-16H,(H,29,31)(H,30,32)
InChIKeyRXMKCGJNHKTGSQ-UHFFFAOYSA-N
MW418.46 g/mol
LogP5.29
Rot. Bonds4

About N-(3-benzamidophenazin-2-yl)benzamide

N-(3-benzamidophenazin-2-yl)benzamide (PubChem CID 3547793) has the molecular formula C26H18N4O2 and a molecular weight of 418.46 g/mol. Its IUPAC name is N-(3-benzamidophenazin-2-yl)benzamide.

Molecular Properties

Compound NameN-(3-benzamidophenazin-2-yl)benzamide
PubChem CID3547793
Molecular FormulaC26H18N4O2
Molecular Weight418.46 g/mol
Exact Mass418.14
IUPAC NameN-(3-benzamidophenazin-2-yl)benzamide
SMILESO=C(Nc1cc2nc3ccccc3nc2cc1NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H18N4O2/c31-25(17-9-3-1-4-10-17)29-23-15-21-22(28-20-14-8-7-13-19(20)27-21)16-24(23)30-26(32)18-11-5-2-6-12-18/h1-16H,(H,29,31)(H,30,32)
InChIKeyRXMKCGJNHKTGSQ-UHFFFAOYSA-N
XLogP5.29
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.46
LogP ≤ 55.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-phenyl-3-[3-(phenylcarbamoylamino)phenazin-2-yl]urea
CID 102390231
N-acridin-9-ylbenzamide
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2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide
CID 29152059
N-(2-methylquinolin-4-yl)-3-sulfanylbenzamide
CID 107020202
N-(3-methylquinoxalin-5-yl)benzamide
CID 141198352
N-(5-methyl-2-prop-1-en-2-ylphenyl)benzamide
CID 154709927
N-[2-(methylamino)phenyl]benzamide
CID 101444547
N-(2,6-diphenylpyrimidin-4-yl)benzamide
CID 11245073
N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
methyl phenazine-2-carboxylate
CID 617185
N-phenylphenanthro[9,10-b]quinoxaline-11-carboxamide
CID 3107678
N-[2-(3,4-dichloroanilino)quinolin-4-yl]benzamide
CID 25223765

Frequently Asked Questions

What is the IUPAC name of N-(3-benzamidophenazin-2-yl)benzamide?
The IUPAC name of N-(3-benzamidophenazin-2-yl)benzamide (CID 3547793) is N-(3-benzamidophenazin-2-yl)benzamide.
What is the SMILES notation for N-(3-benzamidophenazin-2-yl)benzamide?
The canonical SMILES for N-(3-benzamidophenazin-2-yl)benzamide is O=C(Nc1cc2nc3ccccc3nc2cc1NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-benzamidophenazin-2-yl)benzamide?
The InChIKey is RXMKCGJNHKTGSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N4O2/c31-25(17-9-3-1-4-10-17)29-23-15-21-22(28-20-14-8-7-13-19(20)27-21)16-24(23)30-26(32)18-11-5-2-6-12-18/h1-16H,(H,29,31)(H,30,32).
What are the key properties of N-(3-benzamidophenazin-2-yl)benzamide?
N-(3-benzamidophenazin-2-yl)benzamide has a molecular weight of 418.46 g/mol, XLogP of 5.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamidophenazin-2-yl)benzamide is sourced from PubChem (CID 3547793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).