3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole

C101H65N13 — CID 159215097

About 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole

3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole (PubChem CID 159215097) has the molecular formula C101H65N13 and a molecular weight of 1460.72 g/mol. Its IUPAC name is 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole.

Molecular Properties

• Compound Name: 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole
• PubChem CID: 159215097
• Molecular Formula: C101H65N13
• Molecular Weight: 1460.72 g/mol
• Exact Mass: 1459.55
• IUPAC Name: 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole
• SMILES: c1ccc(-c2ccccc2-c2nc(-c3cccc(-n4c5ccccc5c5c6ccn(-c7ccccc7)c6ccc54)c3)nc3ccccc23)cc1.c1ccc(-n2ccc3ccc4c(c5ccccc5n4-c4ncc5ccccc5n4)c32)cc1.c1ccc(-n2ccc3ccc4c(c5ccccc5n4-c4ncc5cnccc5n4)c32)cc1
• InChI: InChI=1S/C46H30N4.C28H18N4.C27H17N5/c1-3-14-31(15-4-1)35-20-7-8-21-36(35)45-37-22-9-11-24-40(37)47-46(48-45)32-16-13-19-34(30-32)50-42-25-12-10-23-38(42)44-39-28-29-49(33-17-5-2-6-18-33)41(39)26-27-43(44)50;1-2-9-21(10-3-1)31-17-16-19-14-15-25-26(27(19)31)22-11-5-7-13-24(22)32(25)28-29-18-20-8-4-6-12-23(20)30-28;1-2-6-20(7-3-1)31-15-13-18-10-11-24-25(26(18)31)21-8-4-5-9-23(21)32(24)27-29-17-19-16-28-14-12-22(19)30-27/h1-30H;1-18H;1-17H
• InChIKey: KQYSNBXJOPLOEU-UHFFFAOYSA-N
• XLogP: 24.41
• TPSA: 119.81 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 9
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1460.72
LogP ≤ 5	24.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole?

The IUPAC name of 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole (CID 159215097) is 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole.

What is the SMILES notation for 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole?

The canonical SMILES for 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole is c1ccc(-c2ccccc2-c2nc(-c3cccc(-n4c5ccccc5c5c6ccn(-c7ccccc7)c6ccc54)c3)nc3ccccc23)cc1.c1ccc(-n2ccc3ccc4c(c5ccccc5n4-c4ncc5ccccc5n4)c32)cc1.c1ccc(-n2ccc3ccc4c(c5ccccc5n4-c4ncc5cnccc5n4)c32)cc1.

What is the InChIKey of 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole?

The InChIKey is KQYSNBXJOPLOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N4.C28H18N4.C27H17N5/c1-3-14-31(15-4-1)35-20-7-8-21-36(35)45-37-22-9-11-24-40(37)47-46(48-45)32-16-13-19-34(30-32)50-42-25-12-10-23-38(42)44-39-28-29-49(33-17-5-2-6-18-33)41(39)26-27-43(44)50;1-2-9-21(10-3-1)31-17-16-19-14-15-25-26(27(19)31)22-11-5-7-13-24(22)32(25)28-29-18-20-8-4-6-12-23(20)30-28;1-2-6-20(7-3-1)31-15-13-18-10-11-24-25(26(18)31)21-8-4-5-9-23(21)32(24)27-29-17-19-16-28-14-12-22(19)30-27/h1-30H;1-18H;1-17H.

What are the key properties of 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole?

3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole has a molecular weight of 1460.72 g/mol, XLogP of 24.41, 9 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 3-phenyl-6-[3-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-c]carbazole;1-phenyl-6-pyrido[4,3-d]pyrimidin-2-ylpyrrolo[3,2-c]carbazole;1-phenyl-6-quinazolin-2-ylpyrrolo[3,2-c]carbazole is sourced from PubChem (CID 159215097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).