2-chloro-4-dibenzofuran-1-ylquinazoline

C20H11ClN2O — CID 126536609

IUPAC2-chloro-4-dibenzofuran-1-ylquinazoline
SMILESClc1nc(-c2cccc3oc4ccccc4c23)c2ccccc2n1
InChIInChI=1S/C20H11ClN2O/c21-20-22-15-9-3-1-6-12(15)19(23-20)14-8-5-11-17-18(14)13-7-2-4-10-16(13)24-17/h1-11H
InChIKeyULFWRHSPTAVNPG-UHFFFAOYSA-N
MW330.77 g/mol
LogP5.85
Rot. Bonds1

About 2-chloro-4-dibenzofuran-1-ylquinazoline

2-chloro-4-dibenzofuran-1-ylquinazoline (PubChem CID 126536609) has the molecular formula C20H11ClN2O and a molecular weight of 330.77 g/mol. Its IUPAC name is 2-chloro-4-dibenzofuran-1-ylquinazoline.

Molecular Properties

Compound Name2-chloro-4-dibenzofuran-1-ylquinazoline
PubChem CID126536609
Molecular FormulaC20H11ClN2O
Molecular Weight330.77 g/mol
Exact Mass330.06
IUPAC Name2-chloro-4-dibenzofuran-1-ylquinazoline
SMILESClc1nc(-c2cccc3oc4ccccc4c23)c2ccccc2n1
InChIInChI=1S/C20H11ClN2O/c21-20-22-15-9-3-1-6-12(15)19(23-20)14-8-5-11-17-18(14)13-7-2-4-10-16(13)24-17/h1-11H
InChIKeyULFWRHSPTAVNPG-UHFFFAOYSA-N
XLogP5.85
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.77
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-4-dibenzofuran-4-ylquinazoline
CID 89282885
2-chloro-4-naphtho[1,2-b][1]benzofuran-5-ylquinazoline
CID 147143483
2-chloro-4-dibenzofuran-1-yl-6-triphenylen-1-yl-1,3,5-triazine
CID 171812786
2-chloro-4-dibenzofuran-1-yl-6-(4-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 177278886
4-dibenzofuran-1-yl-2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)quinazoline
CID 167087660
4-dibenzofuran-1-yl-2-phenylquinoline
CID 146337940
2-chloro-4-phenyl-[1]benzofuro[2,3-d]pyrimidine
CID 118543898
2-chloro-6-dibenzofuran-4-yl-4-phenylquinazoline
CID 139327756
2,4-dichloro-6-(2-dibenzofuran-1-yl-6-fluorophenyl)-1,3,5-triazine
CID 171578577
9-(3-dibenzofuran-1-ylquinoxalin-2-yl)carbazole
CID 166849499
12-(4-dibenzofuran-1-ylquinazolin-2-yl)-12-azapentacyclo[11.7.1.02,11.04,9.017,21]henicosa-1(20),2,4,6,8,10,13,15,17(21),18-decaene
CID 149123745
2-chloro-4-[4-[8-(4-phenylphenyl)naphthalen-1-yl]phenyl]-[1]benzofuro[2,3-d]pyrimidine
CID 177283221

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-dibenzofuran-1-ylquinazoline?
The IUPAC name of 2-chloro-4-dibenzofuran-1-ylquinazoline (CID 126536609) is 2-chloro-4-dibenzofuran-1-ylquinazoline.
What is the SMILES notation for 2-chloro-4-dibenzofuran-1-ylquinazoline?
The canonical SMILES for 2-chloro-4-dibenzofuran-1-ylquinazoline is Clc1nc(-c2cccc3oc4ccccc4c23)c2ccccc2n1.
What is the InChIKey of 2-chloro-4-dibenzofuran-1-ylquinazoline?
The InChIKey is ULFWRHSPTAVNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11ClN2O/c21-20-22-15-9-3-1-6-12(15)19(23-20)14-8-5-11-17-18(14)13-7-2-4-10-16(13)24-17/h1-11H.
What are the key properties of 2-chloro-4-dibenzofuran-1-ylquinazoline?
2-chloro-4-dibenzofuran-1-ylquinazoline has a molecular weight of 330.77 g/mol, XLogP of 5.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-dibenzofuran-1-ylquinazoline is sourced from PubChem (CID 126536609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).