9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole

C33H27N4- — CID 144963874

IUPAC9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole
SMILESc1ccc(C2[N-]C(c3ccccc3)NC(c3cccc(-n4c5ccccc5c5ccccc54)c3)N2)cc1
InChIInChI=1S/C33H27N4/c1-3-12-23(13-4-1)31-34-32(24-14-5-2-6-15-24)36-33(35-31)25-16-11-17-26(22-25)37-29-20-9-7-18-27(29)28-19-8-10-21-30(28)37/h1-22,31-33,35-36H/q-1
InChIKeyVXMHLNIVZUNOHE-UHFFFAOYSA-N
MW479.61 g/mol
LogP7.75
Rot. Bonds4

About 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole

9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole (PubChem CID 144963874) has the molecular formula C33H27N4- and a molecular weight of 479.61 g/mol. Its IUPAC name is 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole
PubChem CID144963874
Molecular FormulaC33H27N4-
Molecular Weight479.61 g/mol
Exact Mass479.22
IUPAC Name9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole
SMILESc1ccc(C2[N-]C(c3ccccc3)NC(c3cccc(-n4c5ccccc5c5ccccc54)c3)N2)cc1
InChIInChI=1S/C33H27N4/c1-3-12-23(13-4-1)31-34-32(24-14-5-2-6-15-24)36-33(35-31)25-16-11-17-26(22-25)37-29-20-9-7-18-27(29)28-19-8-10-21-30(28)37/h1-22,31-33,35-36H/q-1
InChIKeyVXMHLNIVZUNOHE-UHFFFAOYSA-N
XLogP7.75
TPSA43.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.61
LogP ≤ 57.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole 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

11-[4-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 163885419
3-[3-[4,6-bis(3-phenylphenyl)-1,3,5-triazinan-2-yl]phenyl]-9-phenylcarbazole
CID 170061394
5-[3-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 166588030
9-(3-carbazol-9-ylphenyl)carbazole;methane
CID 157215827
15-[3-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-10-phenyl-25-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene
CID 126677995
11-[3-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-15-phenyl-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene
CID 126678107
9-[3-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-3-phenyl-3,4-dihydrocarbazole
CID 145085569
3-carbazol-9-ylbenzenethiol
CID 138734819
4-[4-[3-([1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]-6-phenyl-1,3,5-triazinan-2-yl]benzonitrile
CID 145085176
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
9-[7-[7-(4,6-diphenyl-1,3,5-triazinan-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole
CID 163867295
5-[4-(4,6-diphenyl-1,3,5-triazinan-2-yl)-1H-pyrrol-2-yl]-7-phenylindolo[2,3-b]carbazole
CID 163706708

Frequently Asked Questions

What is the IUPAC name of 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole?
The IUPAC name of 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole (CID 144963874) is 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole is c1ccc(C2[N-]C(c3ccccc3)NC(c3cccc(-n4c5ccccc5c5ccccc54)c3)N2)cc1.
What is the InChIKey of 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole?
The InChIKey is VXMHLNIVZUNOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27N4/c1-3-12-23(13-4-1)31-34-32(24-14-5-2-6-15-24)36-33(35-31)25-16-11-17-26(22-25)37-29-20-9-7-18-27(29)28-19-8-10-21-30(28)37/h1-22,31-33,35-36H/q-1.
What are the key properties of 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole?
9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole has a molecular weight of 479.61 g/mol, XLogP of 7.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(4,6-diphenyl-1,3-diaza-5-azanidacyclohex-2-yl)phenyl]carbazole is sourced from PubChem (CID 144963874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).