2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole

C38H31NO2 — CID 143851120

IUPAC2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole
SMILESc1ccc(N2c3ccccc3CC2c2ccc(C3CCC(c4ccc(-c5cc6ccccc6o5)cc4)O3)cc2)cc1
InChIInChI=1S/C38H31NO2/c1-2-10-32(11-3-1)39-33-12-6-4-8-30(33)24-34(39)26-14-16-27(17-15-26)36-22-23-37(40-36)28-18-20-29(21-19-28)38-25-31-9-5-7-13-35(31)41-38/h1-21,25,34,36-37H,22-24H2
InChIKeyMYMNZUQHXKYXNZ-UHFFFAOYSA-N
MW533.67 g/mol
LogP10.13
Rot. Bonds5

About 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole

2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole (PubChem CID 143851120) has the molecular formula C38H31NO2 and a molecular weight of 533.67 g/mol. Its IUPAC name is 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole.

Molecular Properties

Compound Name2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole
PubChem CID143851120
Molecular FormulaC38H31NO2
Molecular Weight533.67 g/mol
Exact Mass533.24
IUPAC Name2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole
SMILESc1ccc(N2c3ccccc3CC2c2ccc(C3CCC(c4ccc(-c5cc6ccccc6o5)cc4)O3)cc2)cc1
InChIInChI=1S/C38H31NO2/c1-2-10-32(11-3-1)39-33-12-6-4-8-30(33)24-34(39)26-14-16-27(17-15-26)36-22-23-37(40-36)28-18-20-29(21-19-28)38-25-31-9-5-7-13-35(31)41-38/h1-21,25,34,36-37H,22-24H2
InChIKeyMYMNZUQHXKYXNZ-UHFFFAOYSA-N
XLogP10.13
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500533.67
LogP ≤ 510.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole with MolForge

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Related Compounds

3-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-9-phenylcarbazole
CID 143850973
4-(1-benzofuran-2-yl)-N,N-diphenylaniline
CID 139080403
4-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-N-phenylaniline
CID 164744662
(1S,5R)-3-[4-(1-benzofuran-2-yl)phenyl]sulfanyl-8-methyl-8-azabicyclo[3.2.1]octane
CID 10193601
3-[9-[4-(1-benzofuran-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 70659036
N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-[(3Z,5Z)-2-methyl-1-phenyl-2,7-dihydro-1-benzazonin-9-yl]phenyl]fluoren-2-amine
CID 126517841
2-(4-methoxyphenyl)-1-benzofuran
CID 10727834
2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
CID 141017099
4-(1-benzofuran-2-yl)-N-ethylaniline
CID 54143610
2-[4-[(E)-2-(4-chlorophenyl)ethenyl]phenyl]-1-benzofuran
CID 88836846
3-(1-benzofuran-2-yl)-5-(4-fluorophenyl)-4,5-dihydro-1,2-oxazole
CID 74538747
2-methyl-1-(4-phenylphenyl)-2,3-dihydroindole
CID 20685477

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole?
The IUPAC name of 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole (CID 143851120) is 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole.
What is the SMILES notation for 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole?
The canonical SMILES for 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole is c1ccc(N2c3ccccc3CC2c2ccc(C3CCC(c4ccc(-c5cc6ccccc6o5)cc4)O3)cc2)cc1.
What is the InChIKey of 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole?
The InChIKey is MYMNZUQHXKYXNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H31NO2/c1-2-10-32(11-3-1)39-33-12-6-4-8-30(33)24-34(39)26-14-16-27(17-15-26)36-22-23-37(40-36)28-18-20-29(21-19-28)38-25-31-9-5-7-13-35(31)41-38/h1-21,25,34,36-37H,22-24H2.
What are the key properties of 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole?
2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole has a molecular weight of 533.67 g/mol, XLogP of 10.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[5-[4-(1-benzofuran-2-yl)phenyl]oxolan-2-yl]phenyl]-1-phenyl-2,3-dihydroindole is sourced from PubChem (CID 143851120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).