2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine

C23H17NOSe — CID 59573451

IUPAC2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine
SMILESCc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1[Se]2
InChIInChI=1S/C23H17NOSe/c1-16-15-22-23(25-16)24(20-13-7-8-14-21(20)26-22)19-12-6-5-11-18(19)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyWFTHFKUAJCQDAB-UHFFFAOYSA-N
MW402.36 g/mol
LogP4.69
Rot. Bonds2

About 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine

2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine (PubChem CID 59573451) has the molecular formula C23H17NOSe and a molecular weight of 402.36 g/mol. Its IUPAC name is 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine.

Molecular Properties

Compound Name2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine
PubChem CID59573451
Molecular FormulaC23H17NOSe
Molecular Weight402.36 g/mol
Exact Mass403.05
IUPAC Name2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine
SMILESCc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1[Se]2
InChIInChI=1S/C23H17NOSe/c1-16-15-22-23(25-16)24(20-13-7-8-14-21(20)26-22)19-12-6-5-11-18(19)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyWFTHFKUAJCQDAB-UHFFFAOYSA-N
XLogP4.69
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.36
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

10-(4-methyl-2-phenylphenyl)phenoselenazine
CID 59572997
2,6-dimethyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzothiazine 4-oxide
CID 59572859
3,7-dimethyl-10-(2-phenylphenyl)phenoxazine
CID 59573736
2,5-dimethyl-3-phenylfuran
CID 598957
2-methyl-6-(2-phenylphenyl)-11H-[1]benzofuro[2,3-b]quinoline
CID 59572686
3,7-dimethyl-10-(2-phenylphenyl)phenothiazine
CID 59572850
4-(2-phenylphenyl)-1,2,4-triazole-3,5-dione
CID 125269943
3-methyl-10-(2,4,6-trimethylphenyl)phenoselenazine
CID 59573436
10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine
CID 160701231
10-(4-tert-butyl-2,6-dimethylphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one
CID 59572729
9-(4-methyl-2-phenylphenyl)furo[3,2-b][1,4]benzothiazine
CID 59573145
6-(4-methyl-2-phenylphenyl)-11H-[1]benzofuro[2,3-b]quinoline
CID 59573295

Frequently Asked Questions

What is the IUPAC name of 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine?
The IUPAC name of 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine (CID 59573451) is 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine.
What is the SMILES notation for 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine?
The canonical SMILES for 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine is Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1[Se]2.
What is the InChIKey of 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine?
The InChIKey is WFTHFKUAJCQDAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NOSe/c1-16-15-22-23(25-16)24(20-13-7-8-14-21(20)26-22)19-12-6-5-11-18(19)17-9-3-2-4-10-17/h2-15H,1H3.
What are the key properties of 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine?
2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine has a molecular weight of 402.36 g/mol, XLogP of 4.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-9-(2-phenylphenyl)furo[3,2-b][1,4]benzoselenazine is sourced from PubChem (CID 59573451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).