2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol

C26H19N3O2 — CID 136828590

IUPAC2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol
SMILESOc1ccccc1/C=N/c1ccc2[nH]c3ccc(/N=C/c4ccccc4O)cc3c2c1
InChIInChI=1S/C26H19N3O2/c30-25-7-3-1-5-17(25)15-27-19-9-11-23-21(13-19)22-14-20(10-12-24(22)29-23)28-16-18-6-2-4-8-26(18)31/h1-16,29-31H/b27-15+,28-16+
InChIKeyGYLRDSTWIVHZNN-DPCVLPDWSA-N
MW405.46 g/mol
LogP6.23
Rot. Bonds4

About 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol

2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol (PubChem CID 136828590) has the molecular formula C26H19N3O2 and a molecular weight of 405.46 g/mol. Its IUPAC name is 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol.

Molecular Properties

Compound Name2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol
PubChem CID136828590
Molecular FormulaC26H19N3O2
Molecular Weight405.46 g/mol
Exact Mass405.15
IUPAC Name2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol
SMILESOc1ccccc1/C=N/c1ccc2[nH]c3ccc(/N=C/c4ccccc4O)cc3c2c1
InChIInChI=1S/C26H19N3O2/c30-25-7-3-1-5-17(25)15-27-19-9-11-23-21(13-19)22-14-20(10-12-24(22)29-23)28-16-18-6-2-4-8-26(18)31/h1-16,29-31H/b27-15+,28-16+
InChIKeyGYLRDSTWIVHZNN-DPCVLPDWSA-N
XLogP6.23
TPSA80.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.46
LogP ≤ 56.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[[2-[4-[5-[(2-hydroxyphenyl)methylideneamino]-1H-benzimidazol-2-yl]phenyl]-1H-benzimidazol-5-yl]iminomethyl]phenol
CID 135470120
2-[[4-[4-[4-[(2-hydroxyphenyl)methylideneamino]phenyl]phenyl]phenyl]iminomethyl]phenol
CID 3900677
palladium;bis(2-(phenyliminomethyl)phenol)
CID 162453521
2-[[4-[[4-[(2-hydroxyphenyl)methylideneamino]phenyl]diselanyl]phenyl]iminomethyl]phenol
CID 170941504
2-[(4-chloro-3-methylphenyl)iminomethyl]phenol
CID 135657353
2-[(3,5-dimethylphenyl)iminomethyl]phenol
CID 4108135
2-[[4-(1,2,2-triphenylethenyl)phenyl]iminomethyl]phenol
CID 137230306
2-[[4-[2-[4-[(2-hydroxyphenyl)methylideneamino]phenyl]ethyl]phenyl]iminomethyl]phenol
CID 135440137
2-[[4-(2-phenylethenyl)phenyl]iminomethyl]phenol
CID 3812353
2-[[4-(hydroxymethyl)phenyl]iminomethyl]phenol
CID 139083924
2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol
CID 140908950
2-[(2-phenyl-1H-indol-3-yl)iminomethyl]phenol
CID 135433888

Frequently Asked Questions

What is the IUPAC name of 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol?
The IUPAC name of 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol (CID 136828590) is 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol.
What is the SMILES notation for 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol?
The canonical SMILES for 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol is Oc1ccccc1/C=N/c1ccc2[nH]c3ccc(/N=C/c4ccccc4O)cc3c2c1.
What is the InChIKey of 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol?
The InChIKey is GYLRDSTWIVHZNN-DPCVLPDWSA-N. The full InChI is InChI=1S/C26H19N3O2/c30-25-7-3-1-5-17(25)15-27-19-9-11-23-21(13-19)22-14-20(10-12-24(22)29-23)28-16-18-6-2-4-8-26(18)31/h1-16,29-31H/b27-15+,28-16+.
What are the key properties of 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol?
2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol has a molecular weight of 405.46 g/mol, XLogP of 6.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol is sourced from PubChem (CID 136828590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).