6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline

C25H20N2 — CID 102255496

IUPAC6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline
SMILESCC1Cc2c(-c3ccccc3)nc(-c3ccccc3)nc2-c2ccccc21
InChIInChI=1S/C25H20N2/c1-17-16-22-23(18-10-4-2-5-11-18)26-25(19-12-6-3-7-13-19)27-24(22)21-15-9-8-14-20(17)21/h2-15,17H,16H2,1H3
InChIKeyJIXNIMCJGJAUPQ-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.14
Rot. Bonds2

About 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline

6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline (PubChem CID 102255496) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline.

Molecular Properties

Compound Name6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline
PubChem CID102255496
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline
SMILESCC1Cc2c(-c3ccccc3)nc(-c3ccccc3)nc2-c2ccccc21
InChIInChI=1S/C25H20N2/c1-17-16-22-23(18-10-4-2-5-11-18)26-25(19-12-6-3-7-13-19)27-24(22)21-15-9-8-14-20(17)21/h2-15,17H,16H2,1H3
InChIKeyJIXNIMCJGJAUPQ-UHFFFAOYSA-N
XLogP6.14
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dichloro-6-methyl-5,6-dihydrobenzo[h]quinazoline
CID 115420771
5-methyl-1,3-diphenyl-4,5-dihydrobenzo[g]indazole
CID 12713181
5-methyl-1,3-diphenyl-4,5-dihydrobenzo[e]indazole
CID 12713194
2,4,5-triphenylquinazoline
CID 23079071
2-(5-methyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)aniline
CID 115419375
2-phenyl-4-[4-(4-phenylquinazolin-2-yl)phenyl]-5H-indeno[1,2-d]pyrimidine
CID 122487429
8-bromo-2,4-diphenyl-5H-indeno[1,2-d]pyrimidine
CID 152936992
2-(5-methyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)butan-2-amine
CID 115419351
2-(2,3-diphenylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 171052479
2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylphenyl]-4,6-diphenyl-1,3,5-triazine
CID 122423525
5-methyl-4-(2-methylphenyl)-6-phenyl-2-(4-phenylphenyl)pyrimidine
CID 123896494
2,4-diphenyl-6-[3-[3-[3-[3-[4-phenyl-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[3-[3-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[3-[4-phenyl-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[3-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[4-phenyl-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]-1,3,5-triazine
CID 157451002

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline?
The IUPAC name of 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline (CID 102255496) is 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline.
What is the SMILES notation for 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline?
The canonical SMILES for 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline is CC1Cc2c(-c3ccccc3)nc(-c3ccccc3)nc2-c2ccccc21.
What is the InChIKey of 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline?
The InChIKey is JIXNIMCJGJAUPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2/c1-17-16-22-23(18-10-4-2-5-11-18)26-25(19-12-6-3-7-13-19)27-24(22)21-15-9-8-14-20(17)21/h2-15,17H,16H2,1H3.
What are the key properties of 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline?
6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline has a molecular weight of 348.45 g/mol, XLogP of 6.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinazoline is sourced from PubChem (CID 102255496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).