2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol

C32H22N4O2 — CID 140908950

IUPAC2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol
SMILESOc1cc2c(cc1/C=N/c1ccccc1/N=C/c1cc3[nH]c4ccccc4c3cc1O)[nH]c1ccccc12
InChIInChI=1S/C32H22N4O2/c37-31-15-23-21-7-1-3-9-25(21)35-29(23)13-19(31)17-33-27-11-5-6-12-28(27)34-18-20-14-30-24(16-32(20)38)22-8-2-4-10-26(22)36-30/h1-18,35-38H/b33-17+,34-18+
InChIKeyUVRVRPFOWFHZPY-WMFSDKRHSA-N
MW494.55 g/mol
LogP7.87
Rot. Bonds4

About 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol

2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol (PubChem CID 140908950) has the molecular formula C32H22N4O2 and a molecular weight of 494.55 g/mol. Its IUPAC name is 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol.

Molecular Properties

Compound Name2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol
PubChem CID140908950
Molecular FormulaC32H22N4O2
Molecular Weight494.55 g/mol
Exact Mass494.17
IUPAC Name2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol
SMILESOc1cc2c(cc1/C=N/c1ccccc1/N=C/c1cc3[nH]c4ccccc4c3cc1O)[nH]c1ccccc12
InChIInChI=1S/C32H22N4O2/c37-31-15-23-21-7-1-3-9-25(21)35-29(23)13-19(31)17-33-27-11-5-6-12-28(27)34-18-20-14-30-24(16-32(20)38)22-8-2-4-10-26(22)36-30/h1-18,35-38H/b33-17+,34-18+
InChIKeyUVRVRPFOWFHZPY-WMFSDKRHSA-N
XLogP7.87
TPSA96.76 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.55
LogP ≤ 57.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol with MolForge

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Related Compounds

7,17,24,34-tetrazanonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1(20),2,4(16),5,8,10,12,14,18,21(33),22,25,27,29,31-pentadecaene
CID 58471811
2-[[6-[(2-hydroxyphenyl)methylideneamino]-9H-carbazol-3-yl]iminomethyl]phenol
CID 136828590
10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol
CID 174364509
1-[2-hydroxy-3-[(2-hydroxyphenyl)iminomethyl]naphthalen-1-yl]-3-[(2-hydroxyphenyl)iminomethyl]naphthalen-2-ol
CID 136596197
11,20-diazaheptacyclo[15.11.0.02,14.04,12.05,10.019,27.021,26]octacosa-1(28),2,4(12),5,7,9,13,15,17,19(27),21,23,25-tridecaene
CID 102495063
2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol;vanadium;hydrate
CID 171376264
chromium;bis(2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol);hydrate
CID 139236258
9H-carbazole
CID 66668984
CID 70460275
CID 70460275
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
2-[(2-phenyl-1H-indol-3-yl)iminomethyl]phenol
CID 135433888

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol?
The IUPAC name of 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol (CID 140908950) is 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol.
What is the SMILES notation for 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol?
The canonical SMILES for 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol is Oc1cc2c(cc1/C=N/c1ccccc1/N=C/c1cc3[nH]c4ccccc4c3cc1O)[nH]c1ccccc12.
What is the InChIKey of 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol?
The InChIKey is UVRVRPFOWFHZPY-WMFSDKRHSA-N. The full InChI is InChI=1S/C32H22N4O2/c37-31-15-23-21-7-1-3-9-25(21)35-29(23)13-19(31)17-33-27-11-5-6-12-28(27)34-18-20-14-30-24(16-32(20)38)22-8-2-4-10-26(22)36-30/h1-18,35-38H/b33-17+,34-18+.
What are the key properties of 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol?
2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol has a molecular weight of 494.55 g/mol, XLogP of 7.87, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(3-hydroxy-9H-carbazol-2-yl)methylideneamino]phenyl]iminomethyl]-9H-carbazol-3-ol is sourced from PubChem (CID 140908950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).