5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin

C36H24N4O4 — CID 54453105

IUPAC5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin
SMILESc1coc(C2=c3ccc([nH]3)=C(c3ccco3)c3ccc([nH]3)C(c3ccco3)=c3ccc([nH]3)=C(c3ccco3)c3ccc2[nH]3)c1
InChIInChI=1S/C36H24N4O4/c1-5-29(41-17-1)33-21-9-11-23(37-21)34(30-6-2-18-42-30)25-13-15-27(39-25)36(32-8-4-20-44-32)28-16-14-26(40-28)35(31-7-3-19-43-31)24-12-10-22(33)38-24/h1-20,37-40H
InChIKeyKKFXFDYPONKRGU-UHFFFAOYSA-N
MW576.61 g/mol
LogP4.67
Rot. Bonds4

About 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin

5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin (PubChem CID 54453105) has the molecular formula C36H24N4O4 and a molecular weight of 576.61 g/mol. Its IUPAC name is 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin.

Molecular Properties

Compound Name5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin
PubChem CID54453105
Molecular FormulaC36H24N4O4
Molecular Weight576.61 g/mol
Exact Mass576.18
IUPAC Name5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin
SMILESc1coc(C2=c3ccc([nH]3)=C(c3ccco3)c3ccc([nH]3)C(c3ccco3)=c3ccc([nH]3)=C(c3ccco3)c3ccc2[nH]3)c1
InChIInChI=1S/C36H24N4O4/c1-5-29(41-17-1)33-21-9-11-23(37-21)34(30-6-2-18-42-30)25-13-15-27(39-25)36(32-8-4-20-44-32)28-16-14-26(40-28)35(31-7-3-19-43-31)24-12-10-22(33)38-24/h1-20,37-40H
InChIKeyKKFXFDYPONKRGU-UHFFFAOYSA-N
XLogP4.67
TPSA115.72 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500576.61
LogP ≤ 54.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2Z)-5-(2-furyl)-3-methoxy-2-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrole
CID 53391816
23-Oxa-24,25-diazatetracyclo[18.2.1.12,5.17,10]pentacosa-2(25),3,5,7,9,15,20,22-octaene, 4-methoxy-, (5Z,15E)-
CID 15955924
(5Z,15E)-4-methoxy-30-oxa-31,32-diazatetracyclo[25.2.1.12,5.17,10]dotriaconta-1(29),2(32),3,5,7,9,15,27-octaene
CID 57339723
21-Oxaporphyrin
CID 68629582
21-Oxa-22,23,24-triazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),3,5,8,10,13,15,18-octaene
CID 23245436
Furylporphyrin
CID 70562368
Tetrafurylporphyrin
CID 135485691
6,6,11,11,20,20,25,25-Octamethyl-30,33-dioxa-29,31,32,34-tetrazaheptacyclo[24.2.1.12,5.17,10.112,15.116,19.121,24]tetratriaconta-1(28),2,4,7,9,12,14,16,18,21,23,26-dodecaene
CID 5243368
5,10,15,20-Tetrakis(furan-2-yl)-21,22-dihydroporphyrin
CID 10348099
2,2,7,7,12,12,17,17-Octamethyl-21,23-dioxa-22,24-diazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),3,5,8,10,13,15,18-octaene
CID 12967127
2,2,7,7,12,12,17,17,22,22,27,27-Dodecamethyl-31,33,35-trioxa-32,34,36-triazaheptacyclo[26.2.1.13,6.18,11.113,16.118,21.123,26]hexatriaconta-1(30),3,5,8,10,13,15,18,20,23,25,28-dodecaene
CID 12967129
21,23-Dioxaporphyrin
CID 86036928

Frequently Asked Questions

What is the IUPAC name of 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin?
The IUPAC name of 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin (CID 54453105) is 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin.
What is the SMILES notation for 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin?
The canonical SMILES for 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin is c1coc(C2=c3ccc([nH]3)=C(c3ccco3)c3ccc([nH]3)C(c3ccco3)=c3ccc([nH]3)=C(c3ccco3)c3ccc2[nH]3)c1.
What is the InChIKey of 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin?
The InChIKey is KKFXFDYPONKRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24N4O4/c1-5-29(41-17-1)33-21-9-11-23(37-21)34(30-6-2-18-42-30)25-13-15-27(39-25)36(32-8-4-20-44-32)28-16-14-26(40-28)35(31-7-3-19-43-31)24-12-10-22(33)38-24/h1-20,37-40H.
What are the key properties of 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin?
5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin has a molecular weight of 576.61 g/mol, XLogP of 4.67, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10,15,20-tetrakis(furan-2-yl)-21,22,23,24-tetrahydroporphyrin is sourced from PubChem (CID 54453105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).