2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine

C12H6Cl2N2O — CID 59592991

IUPAC2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine
SMILESClc1nc(Cl)c2oc(-c3ccccc3)cc2n1
InChIInChI=1S/C12H6Cl2N2O/c13-11-10-8(15-12(14)16-11)6-9(17-10)7-4-2-1-3-5-7/h1-6H
InChIKeyDXEHJHIJGWGMPH-UHFFFAOYSA-N
MW265.10 g/mol
LogP4.20
Rot. Bonds1

About 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine

2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine (PubChem CID 59592991) has the molecular formula C12H6Cl2N2O and a molecular weight of 265.10 g/mol. Its IUPAC name is 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine.

Molecular Properties

Compound Name2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine
PubChem CID59592991
Molecular FormulaC12H6Cl2N2O
Molecular Weight265.10 g/mol
Exact Mass263.99
IUPAC Name2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine
SMILESClc1nc(Cl)c2oc(-c3ccccc3)cc2n1
InChIInChI=1S/C12H6Cl2N2O/c13-11-10-8(15-12(14)16-11)6-9(17-10)7-4-2-1-3-5-7/h1-6H
InChIKeyDXEHJHIJGWGMPH-UHFFFAOYSA-N
XLogP4.20
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.10
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine?
The IUPAC name of 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine (CID 59592991) is 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine.
What is the SMILES notation for 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine?
The canonical SMILES for 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine is Clc1nc(Cl)c2oc(-c3ccccc3)cc2n1.
What is the InChIKey of 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine?
The InChIKey is DXEHJHIJGWGMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2N2O/c13-11-10-8(15-12(14)16-11)6-9(17-10)7-4-2-1-3-5-7/h1-6H.
What are the key properties of 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine?
2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine has a molecular weight of 265.10 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-phenylfuro[3,2-d]pyrimidine is sourced from PubChem (CID 59592991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).