10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine

C34H30N2S — CID 59399701

IUPAC10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)s2)c2ccccc21
InChIInChI=1S/C34H30N2S/c1-33(2)23-13-5-9-17-27(23)35(28-18-10-6-14-24(28)33)31-21-22-32(37-31)36-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)36/h5-22H,1-4H3
InChIKeySLGUPNXYGPRGNN-UHFFFAOYSA-N
MW498.70 g/mol
LogP9.97
Rot. Bonds2

About 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine

10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine (PubChem CID 59399701) has the molecular formula C34H30N2S and a molecular weight of 498.70 g/mol. Its IUPAC name is 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine.

Molecular Properties

Compound Name10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine
PubChem CID59399701
Molecular FormulaC34H30N2S
Molecular Weight498.70 g/mol
Exact Mass498.21
IUPAC Name10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)s2)c2ccccc21
InChIInChI=1S/C34H30N2S/c1-33(2)23-13-5-9-17-27(23)35(28-18-10-6-14-24(28)33)31-21-22-32(37-31)36-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)36/h5-22H,1-4H3
InChIKeySLGUPNXYGPRGNN-UHFFFAOYSA-N
XLogP9.97
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.70
LogP ≤ 59.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine?
The IUPAC name of 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine (CID 59399701) is 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine.
What is the SMILES notation for 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine?
The canonical SMILES for 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine is CC1(C)c2ccccc2N(c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)s2)c2ccccc21.
What is the InChIKey of 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine?
The InChIKey is SLGUPNXYGPRGNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H30N2S/c1-33(2)23-13-5-9-17-27(23)35(28-18-10-6-14-24(28)33)31-21-22-32(37-31)36-29-19-11-7-15-25(29)34(3,4)26-16-8-12-20-30(26)36/h5-22H,1-4H3.
What are the key properties of 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine?
10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine has a molecular weight of 498.70 g/mol, XLogP of 9.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine is sourced from PubChem (CID 59399701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).