2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol

C22H23N3O — CID 159207035

IUPAC2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol
SMILESCC.CO.c1ccc(-c2cnc3cnc(-c4ccccc4)nc3c2)cc1
InChIInChI=1S/C19H13N3.C2H6.CH4O/c1-3-7-14(8-4-1)16-11-17-18(20-12-16)13-21-19(22-17)15-9-5-2-6-10-15;2*1-2/h1-13H;1-2H3;2H,1H3
InChIKeyKPZZCLUYIAVVAM-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.99
Rot. Bonds2

About 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol

2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol (PubChem CID 159207035) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol.

Molecular Properties

Compound Name2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol
PubChem CID159207035
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol
SMILESCC.CO.c1ccc(-c2cnc3cnc(-c4ccccc4)nc3c2)cc1
InChIInChI=1S/C19H13N3.C2H6.CH4O/c1-3-7-14(8-4-1)16-11-17-18(20-12-16)13-21-19(22-17)15-9-5-2-6-10-15;2*1-2/h1-13H;1-2H3;2H,1H3
InChIKeyKPZZCLUYIAVVAM-UHFFFAOYSA-N
XLogP4.99
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenylquinazoline-6,7-diol
CID 137014839
2-phenylquinazoline
CID 158733567
7-methyl-2-phenylquinazoline
CID 102363369
3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 58322553
3-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 58322543
3-phenylquinoline-7-carboxylic acid
CID 68924560
5-(4-methylphenyl)-2-[4-(2-phenylpyrimidin-5-yl)phenyl]pyrimidine
CID 21044112
2-chloro-3-methyl-6-phenylimidazo[4,5-b]pyridine
CID 10466968
N'-(2-phenylquinazolin-7-yl)ethanimidamide
CID 23085689
2-phenylquinazoline-7-carbonyl chloride
CID 169130790
3-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]quinoline
CID 58462308
3-[4-(4-phenylphenyl)-6-quinolin-3-yl-1,3,5-triazin-2-yl]quinoline
CID 122426515

Frequently Asked Questions

What is the IUPAC name of 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol?
The IUPAC name of 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol (CID 159207035) is 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol.
What is the SMILES notation for 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol?
The canonical SMILES for 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol is CC.CO.c1ccc(-c2cnc3cnc(-c4ccccc4)nc3c2)cc1.
What is the InChIKey of 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol?
The InChIKey is KPZZCLUYIAVVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3.C2H6.CH4O/c1-3-7-14(8-4-1)16-11-17-18(20-12-16)13-21-19(22-17)15-9-5-2-6-10-15;2*1-2/h1-13H;1-2H3;2H,1H3.
What are the key properties of 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol?
2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol has a molecular weight of 345.45 g/mol, XLogP of 4.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-diphenylpyrido[3,2-d]pyrimidine;ethane;methanol is sourced from PubChem (CID 159207035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).