9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine

C37H30N4 — CID 168805920

IUPAC9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine
SMILESCc1nc(-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)nc(-c2cccc(-c3ccccc3)c2)n1
InChIInChI=1S/C37H30N4/c1-25-38-35(40-36(39-25)29-15-11-14-28(24-29)26-12-5-4-6-13-26)27-20-22-30(23-21-27)41-33-18-9-7-16-31(33)37(2,3)32-17-8-10-19-34(32)41/h4-24H,1-3H3
InChIKeyCDGWUBXBUKCBLP-UHFFFAOYSA-N
MW530.68 g/mol
LogP9.29
Rot. Bonds4

About 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine

9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine (PubChem CID 168805920) has the molecular formula C37H30N4 and a molecular weight of 530.68 g/mol. Its IUPAC name is 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine.

Molecular Properties

Compound Name9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine
PubChem CID168805920
Molecular FormulaC37H30N4
Molecular Weight530.68 g/mol
Exact Mass530.25
IUPAC Name9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine
SMILESCc1nc(-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)nc(-c2cccc(-c3ccccc3)c2)n1
InChIInChI=1S/C37H30N4/c1-25-38-35(40-36(39-25)29-15-11-14-28(24-29)26-12-5-4-6-13-26)27-20-22-30(23-21-27)41-33-18-9-7-16-31(33)37(2,3)32-17-8-10-19-34(32)41/h4-24H,1-3H3
InChIKeyCDGWUBXBUKCBLP-UHFFFAOYSA-N
XLogP9.29
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.68
LogP ≤ 59.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine 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

2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine
CID 118472949
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528441
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethyl-10-phenylacridine
CID 71007166
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528442
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 157103657
10-[3-(9,9-dimethylacridin-10-yl)-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528452
10-[4-[3-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethylacridine
CID 163739156
2-bromo-10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethylacridine
CID 172991970
2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-dimethylthioxanthen-2-yl]-9,9-dimethyl-10-phenylacridine
CID 134578950
10-[3-[4-[3-(9,9-dimethyl-10-phenylacridin-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene
CID 170682872
10-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-dimethylthioxanthen-3-yl]-9,9-dimethylacridine
CID 153150378
9,9-dimethyl-10-[4-[4-[2-methyl-3-[2-[2-(2-methylphenyl)phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]acridine
CID 130380034

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine?
The IUPAC name of 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine (CID 168805920) is 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine.
What is the SMILES notation for 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine?
The canonical SMILES for 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine is Cc1nc(-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)nc(-c2cccc(-c3ccccc3)c2)n1.
What is the InChIKey of 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine?
The InChIKey is CDGWUBXBUKCBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H30N4/c1-25-38-35(40-36(39-25)29-15-11-14-28(24-29)26-12-5-4-6-13-26)27-20-22-30(23-21-27)41-33-18-9-7-16-31(33)37(2,3)32-17-8-10-19-34(32)41/h4-24H,1-3H3.
What are the key properties of 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine?
9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine has a molecular weight of 530.68 g/mol, XLogP of 9.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-[4-[4-methyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine is sourced from PubChem (CID 168805920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).