11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline

C31H20N4 — CID 44583948

IUPAC11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline
SMILESCn1c2nc3ccccc3c-2c(-n2c3ccccc3c3nc4ccccc4cc32)c2ccccc21
InChIInChI=1S/C31H20N4/c1-34-25-16-8-5-13-22(25)30(28-20-11-3-7-15-24(20)33-31(28)34)35-26-17-9-4-12-21(26)29-27(35)18-19-10-2-6-14-23(19)32-29/h2-18H,1H3
InChIKeyCGEFFBTUAHALFW-UHFFFAOYSA-N
MW448.53 g/mol
LogP7.48
Rot. Bonds1

About 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline

11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline (PubChem CID 44583948) has the molecular formula C31H20N4 and a molecular weight of 448.53 g/mol. Its IUPAC name is 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline.

Molecular Properties

Compound Name11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline
PubChem CID44583948
Molecular FormulaC31H20N4
Molecular Weight448.53 g/mol
Exact Mass448.17
IUPAC Name11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline
SMILESCn1c2nc3ccccc3c-2c(-n2c3ccccc3c3nc4ccccc4cc32)c2ccccc21
InChIInChI=1S/C31H20N4/c1-34-25-16-8-5-13-22(25)30(28-20-11-3-7-15-24(20)33-31(28)34)35-26-17-9-4-12-21(26)29-27(35)18-19-10-2-6-14-23(19)32-29/h2-18H,1H3
InChIKeyCGEFFBTUAHALFW-UHFFFAOYSA-N
XLogP7.48
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.53
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline?
The IUPAC name of 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline (CID 44583948) is 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline.
What is the SMILES notation for 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline?
The canonical SMILES for 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline is Cn1c2nc3ccccc3c-2c(-n2c3ccccc3c3nc4ccccc4cc32)c2ccccc21.
What is the InChIKey of 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline?
The InChIKey is CGEFFBTUAHALFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H20N4/c1-34-25-16-8-5-13-22(25)30(28-20-11-3-7-15-24(20)33-31(28)34)35-26-17-9-4-12-21(26)29-27(35)18-19-10-2-6-14-23(19)32-29/h2-18H,1H3.
What are the key properties of 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline?
11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline has a molecular weight of 448.53 g/mol, XLogP of 7.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-indolo[3,2-b]quinolin-10-yl-5-methylindolo[2,3-b]quinoline is sourced from PubChem (CID 44583948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).