diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))

C150H90N13O9PPt4 — CID 157161363

IUPACdiphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))
SMILESCN1c2cc3cccc(-c4noc5ccccc45)c3[c-]c2N(c2[c-]c3c(-c4ccccn4)coc3o2)c2ccccc21.Cn1c(-c2cccc3oc(N(c4ccccc4)c4ccc5occ(-c6cc7ccccc7cn6)c5n4)[c-]c23)nc2ccccc21.O=C(c1ccccc1)c1coc2ccc(-n3c4[c-]c5c(-c6ccccn6)cccc5cc4c4ccccc43)[c-]c12.[Pt+2].[Pt+2].[Pt+2].[Pt].[c-]1c2c(cc3cccc(-c4ccccn4)c13)Oc1ccccc1N2c1[c-]c2c([PH+](c3ccccc3)c3ccccc3)cccc2o1
InChIInChI=1S/C41H25N2O2P.C38H24N5O2.C36H20N2O2.C35H20N4O3.4Pt/c1-3-14-29(15-4-1)46(30-16-5-2-6-17-30)40-23-12-22-37-33(40)27-41(45-37)43-35-20-7-8-21-38(35)44-39-25-28-13-11-18-31(32(28)26-36(39)43)34-19-9-10-24-42-34;1-42-32-16-8-7-15-30(32)40-38(42)27-14-9-17-33-28(27)21-36(45-33)43(26-12-3-2-4-13-26)35-19-18-34-37(41-35)29(23-44-34)31-20-24-10-5-6-11-25(24)22-39-31;39-36(23-9-2-1-3-10-23)31-22-40-35-17-16-25(20-30(31)35)38-33-15-5-4-12-27(33)29-19-24-11-8-13-26(28(24)21-34(29)38)32-14-6-7-18-37-32;1-38-28-13-3-4-14-29(28)39(33-19-25-26(20-40-35(25)41-33)27-12-6-7-16-36-27)31-18-24-21(17-30(31)38)9-8-11-22(24)34-23-10-2-5-15-32(23)42-37-34;;;;/h1-25H;2-20,22-23H,1H3;1-19,22H;2-17,20H,1H3;;;;/q-2;-1;2*-2;;3*+2/p+1
InChIKeyJQGVCIRBLCMJTP-UHFFFAOYSA-O
MW3029.74 g/mol
LogP36.69
Rot. Bonds17

About diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))

diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) (PubChem CID 157161363) has the molecular formula C150H90N13O9PPt4 and a molecular weight of 3029.74 g/mol. Its IUPAC name is diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)).

Molecular Properties

Compound Namediphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))
PubChem CID157161363
Molecular FormulaC150H90N13O9PPt4
Molecular Weight3029.74 g/mol
Exact Mass3027.53
IUPAC Namediphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))
SMILESCN1c2cc3cccc(-c4noc5ccccc45)c3[c-]c2N(c2[c-]c3c(-c4ccccn4)coc3o2)c2ccccc21.Cn1c(-c2cccc3oc(N(c4ccccc4)c4ccc5occ(-c6cc7ccccc7cn6)c5n4)[c-]c23)nc2ccccc21.O=C(c1ccccc1)c1coc2ccc(-n3c4[c-]c5c(-c6ccccn6)cccc5cc4c4ccccc43)[c-]c12.[Pt+2].[Pt+2].[Pt+2].[Pt].[c-]1c2c(cc3cccc(-c4ccccn4)c13)Oc1ccccc1N2c1[c-]c2c([PH+](c3ccccc3)c3ccccc3)cccc2o1
InChIInChI=1S/C41H25N2O2P.C38H24N5O2.C36H20N2O2.C35H20N4O3.4Pt/c1-3-14-29(15-4-1)46(30-16-5-2-6-17-30)40-23-12-22-37-33(40)27-41(45-37)43-35-20-7-8-21-38(35)44-39-25-28-13-11-18-31(32(28)26-36(39)43)34-19-9-10-24-42-34;1-42-32-16-8-7-15-30(32)40-38(42)27-14-9-17-33-28(27)21-36(45-33)43(26-12-3-2-4-13-26)35-19-18-34-37(41-35)29(23-44-34)31-20-24-10-5-6-11-25(24)22-39-31;39-36(23-9-2-1-3-10-23)31-22-40-35-17-16-25(20-30(31)35)38-33-15-5-4-12-27(33)29-19-24-11-8-13-26(28(24)21-34(29)38)32-14-6-7-18-37-32;1-38-28-13-3-4-14-29(28)39(33-19-25-26(20-40-35(25)41-33)27-12-6-7-16-36-27)31-18-24-21(17-30(31)38)9-8-11-22(24)34-23-10-2-5-15-32(23)42-37-34;;;;/h1-25H;2-20,22-23H,1H3;1-19,22H;2-17,20H,1H3;;;;/q-2;-1;2*-2;;3*+2/p+1
InChIKeyJQGVCIRBLCMJTP-UHFFFAOYSA-O
XLogP36.69
TPSA231.33 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds17
Heavy Atoms177
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003029.74
LogP ≤ 536.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))?
The IUPAC name of diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) (CID 157161363) is diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)).
What is the SMILES notation for diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))?
The canonical SMILES for diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) is CN1c2cc3cccc(-c4noc5ccccc45)c3[c-]c2N(c2[c-]c3c(-c4ccccn4)coc3o2)c2ccccc21.Cn1c(-c2cccc3oc(N(c4ccccc4)c4ccc5occ(-c6cc7ccccc7cn6)c5n4)[c-]c23)nc2ccccc21.O=C(c1ccccc1)c1coc2ccc(-n3c4[c-]c5c(-c6ccccn6)cccc5cc4c4ccccc43)[c-]c12.[Pt+2].[Pt+2].[Pt+2].[Pt].[c-]1c2c(cc3cccc(-c4ccccn4)c13)Oc1ccccc1N2c1[c-]c2c([PH+](c3ccccc3)c3ccccc3)cccc2o1.
What is the InChIKey of diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))?
The InChIKey is JQGVCIRBLCMJTP-UHFFFAOYSA-O. The full InChI is InChI=1S/C41H25N2O2P.C38H24N5O2.C36H20N2O2.C35H20N4O3.4Pt/c1-3-14-29(15-4-1)46(30-16-5-2-6-17-30)40-23-12-22-37-33(40)27-41(45-37)43-35-20-7-8-21-38(35)44-39-25-28-13-11-18-31(32(28)26-36(39)43)34-19-9-10-24-42-34;1-42-32-16-8-7-15-30(32)40-38(42)27-14-9-17-33-28(27)21-36(45-33)43(26-12-3-2-4-13-26)35-19-18-34-37(41-35)29(23-44-34)31-20-24-10-5-6-11-25(24)22-39-31;39-36(23-9-2-1-3-10-23)31-22-40-35-17-16-25(20-30(31)35)38-33-15-5-4-12-27(33)29-19-24-11-8-13-26(28(24)21-34(29)38)32-14-6-7-18-37-32;1-38-28-13-3-4-14-29(28)39(33-19-25-26(20-40-35(25)41-33)27-12-6-7-16-36-27)31-18-24-21(17-30(31)38)9-8-11-22(24)34-23-10-2-5-15-32(23)42-37-34;;;;/h1-25H;2-20,22-23H,1H3;1-19,22H;2-17,20H,1H3;;;;/q-2;-1;2*-2;;3*+2/p+1.
What are the key properties of diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+))?
diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) has a molecular weight of 3029.74 g/mol, XLogP of 36.69, 17 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[2-(10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-id-12-yl)-3H-1-benzofuran-3-id-4-yl]phosphanium;3-isoquinolin-3-yl-N-[4-(1-methylbenzimidazol-2-yl)-3H-1-benzofuran-3-id-2-yl]-N-phenylfuro[3,2-b]pyridin-5-amine;3-[12-methyl-5-(3-pyridin-2-yl-4H-furo[2,3-b]furan-4-id-5-yl)-6H-benzo[b]phenazin-6-id-7-yl]-1,2-benzoxazole;phenyl-[5-(7-pyridin-2-yl-6H-benzo[b]carbazol-6-id-5-yl)-4H-1-benzofuran-4-id-3-yl]methanone;platinum;tris(platinum(2+)) is sourced from PubChem (CID 157161363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).