1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol

C40H28N2O2 — CID 170680295

IUPAC1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol
SMILESCn1c2ccccc2c2c(-c3c(O)ccc4ccccc34)c3c(c(-c4c(O)ccc5ccccc45)c21)c1ccccc1n3C
InChIInChI=1S/C40H28N2O2/c1-41-29-17-9-7-15-27(29)35-38(34-26-14-6-4-12-24(26)20-22-32(34)44)40-36(28-16-8-10-18-30(28)42(40)2)37(39(35)41)33-25-13-5-3-11-23(25)19-21-31(33)43/h3-22,43-44H,1-2H3
InChIKeyUGXIVMLZNKYACB-UHFFFAOYSA-N
MW568.68 g/mol
LogP10.03
Rot. Bonds2

About 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol

1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol (PubChem CID 170680295) has the molecular formula C40H28N2O2 and a molecular weight of 568.68 g/mol. Its IUPAC name is 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol
PubChem CID170680295
Molecular FormulaC40H28N2O2
Molecular Weight568.68 g/mol
Exact Mass568.22
IUPAC Name1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol
SMILESCn1c2ccccc2c2c(-c3c(O)ccc4ccccc34)c3c(c(-c4c(O)ccc5ccccc45)c21)c1ccccc1n3C
InChIInChI=1S/C40H28N2O2/c1-41-29-17-9-7-15-27(29)35-38(34-26-14-6-4-12-24(26)20-22-32(34)44)40-36(28-16-8-10-18-30(28)42(40)2)37(39(35)41)33-25-13-5-3-11-23(25)19-21-31(33)43/h3-22,43-44H,1-2H3
InChIKeyUGXIVMLZNKYACB-UHFFFAOYSA-N
XLogP10.03
TPSA50.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500568.68
LogP ≤ 510.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol with MolForge

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Related Compounds

tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
5,11-dimethyl-6,12-dinaphthalen-1-ylindolo[3,2-b]carbazole
CID 163788031
4-(3-hydroxy-9-methylcarbazol-4-yl)-9-methylcarbazol-3-ol
CID 169016358
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);hexakis(propan-2-ol);titanium
CID 134903058
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;N-methyl-N-phosphanylmethanamine
CID 142347259
1-(9-methoxy-11-methylbenzo[a]carbazol-6-yl)naphthalen-2-ol
CID 138984745
bis(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);bis(propan-2-ol);titanium;hydrate
CID 11764266
cyanic acid;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 70289333
ethoxyethane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;2-(2-hydroxyphenyl)phenol
CID 67656533
diphenylarsorylbenzene;gadolinium(3+);1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 11468369
5,6,11,12-tetramethylindolo[3,2-b]carbazole
CID 134194403

Frequently Asked Questions

What is the IUPAC name of 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol?
The IUPAC name of 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol (CID 170680295) is 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol.
What is the SMILES notation for 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol?
The canonical SMILES for 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol is Cn1c2ccccc2c2c(-c3c(O)ccc4ccccc34)c3c(c(-c4c(O)ccc5ccccc45)c21)c1ccccc1n3C.
What is the InChIKey of 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol?
The InChIKey is UGXIVMLZNKYACB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N2O2/c1-41-29-17-9-7-15-27(29)35-38(34-26-14-6-4-12-24(26)20-22-32(34)44)40-36(28-16-8-10-18-30(28)42(40)2)37(39(35)41)33-25-13-5-3-11-23(25)19-21-31(33)43/h3-22,43-44H,1-2H3.
What are the key properties of 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol?
1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol has a molecular weight of 568.68 g/mol, XLogP of 10.03, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[12-(2-hydroxynaphthalen-1-yl)-5,11-dimethylindolo[3,2-b]carbazol-6-yl]naphthalen-2-ol is sourced from PubChem (CID 170680295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).