N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide

C37H28N2O3 — CID 56593604

IUPACN-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide
SMILESO=C(NC1=C(c2ccccc2)c2ccccc2OC1)c1ccccc1NC1=C(c2ccccc2)c2ccccc2OC1
InChIInChI=1S/C37H28N2O3/c40-37(39-32-24-42-34-22-12-9-19-29(34)36(32)26-15-5-2-6-16-26)27-17-7-10-20-30(27)38-31-23-41-33-21-11-8-18-28(33)35(31)25-13-3-1-4-14-25/h1-22,38H,23-24H2,(H,39,40)
InChIKeyLLBSNQJGUWEAIN-UHFFFAOYSA-N
MW548.64 g/mol
LogP7.53
Rot. Bonds6

About N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide

N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide (PubChem CID 56593604) has the molecular formula C37H28N2O3 and a molecular weight of 548.64 g/mol. Its IUPAC name is N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide.

Molecular Properties

Compound NameN-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide
PubChem CID56593604
Molecular FormulaC37H28N2O3
Molecular Weight548.64 g/mol
Exact Mass548.21
IUPAC NameN-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide
SMILESO=C(NC1=C(c2ccccc2)c2ccccc2OC1)c1ccccc1NC1=C(c2ccccc2)c2ccccc2OC1
InChIInChI=1S/C37H28N2O3/c40-37(39-32-24-42-34-22-12-9-19-29(34)36(32)26-15-5-2-6-16-26)27-17-7-10-20-30(27)38-31-23-41-33-21-11-8-18-28(33)35(31)25-13-3-1-4-14-25/h1-22,38H,23-24H2,(H,39,40)
InChIKeyLLBSNQJGUWEAIN-UHFFFAOYSA-N
XLogP7.53
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500548.64
LogP ≤ 57.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide 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

2-phenyl-N-(2-phenylphenyl)benzamide
CID 2216278
sodium 2-[(3-oxo-2-phenylinden-1-yl)amino]benzoate
CID 56842664
(4-phenyl-2H-chromen-3-yl)methanamine;hydrochloride
CID 122621323
N'-(2-anilinobenzoyl)-2,3-dihydro-1-benzofuran-2-carbohydrazide
CID 86874325
N-(6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-phenylbenzamide
CID 86878163
(3S)-N-(2-phenylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 1084125
N-(1,3-benzodioxol-5-yl)-2-(4-fluoroanilino)benzamide
CID 30887113
(E)-1-[4-(3-phenyl-2H-chromen-4-yl)phenyl]pent-1-en-3-one
CID 142214852
N-(4H-chromeno[4,3-d][1,3]thiazol-2-yl)-4-phenylbenzamide
CID 4583151
2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide
CID 9106026
N-(2-hydroxyphenyl)-2,3-dihydro-1,4-benzodioxine-5-carboxamide
CID 47455792
methyl 3-phenyl-1,4-dihydrochromeno[4,3-b]pyrrole-2-carboxylate
CID 12559936

Frequently Asked Questions

What is the IUPAC name of N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide?
The IUPAC name of N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide (CID 56593604) is N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide.
What is the SMILES notation for N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide?
The canonical SMILES for N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide is O=C(NC1=C(c2ccccc2)c2ccccc2OC1)c1ccccc1NC1=C(c2ccccc2)c2ccccc2OC1.
What is the InChIKey of N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide?
The InChIKey is LLBSNQJGUWEAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H28N2O3/c40-37(39-32-24-42-34-22-12-9-19-29(34)36(32)26-15-5-2-6-16-26)27-17-7-10-20-30(27)38-31-23-41-33-21-11-8-18-28(33)35(31)25-13-3-1-4-14-25/h1-22,38H,23-24H2,(H,39,40).
What are the key properties of N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide?
N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide has a molecular weight of 548.64 g/mol, XLogP of 7.53, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyl-2H-chromen-3-yl)-2-[(4-phenyl-2H-chromen-3-yl)amino]benzamide is sourced from PubChem (CID 56593604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).