9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole

C101H63N11 — CID 163988969

About 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole

9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole (PubChem CID 163988969) has the molecular formula C101H63N11 and a molecular weight of 1430.69 g/mol. Its IUPAC name is 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole.

Molecular Properties

• Compound Name: 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole
• PubChem CID: 163988969
• Molecular Formula: C101H63N11
• Molecular Weight: 1430.69 g/mol
• Exact Mass: 1429.53
• IUPAC Name: 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole
• SMILES: c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6cccc(-c7ccc(-c8cc(-c9cccc(-n%10c%11ccc(-c%12cccc%13c%12c%12ccccc%12n%13-c%12ccccc%12)cc%11c%11cccnc%11%10)c9)cc(-c9ccccn9)n8)nc7)c6)cc5c5cccnc54)c3)n2)cc1
• InChI: InChI=1S/C101H63N11/c1-4-23-64(24-5-1)87-62-88(65-25-6-2-7-26-65)108-99(107-87)70-29-18-34-76(57-70)112-94-51-48-69(59-84(94)80-40-22-54-104-101(80)112)78-38-20-45-96-98(78)82-36-11-13-43-92(82)110(96)74-32-16-27-66(55-74)71-46-49-86(105-63-71)90-61-72(60-89(106-90)85-41-14-15-52-102-85)67-28-17-33-75(56-67)111-93-50-47-68(58-83(93)79-39-21-53-103-100(79)111)77-37-19-44-95-97(77)81-35-10-12-42-91(81)109(95)73-30-8-3-9-31-73/h1-63H
• InChIKey: TYWDYHRLVVSRLQ-UHFFFAOYSA-N
• XLogP: 24.84
• TPSA: 109.95 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 13
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1430.69
LogP ≤ 5	24.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole?

The IUPAC name of 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole (CID 163988969) is 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole.

What is the SMILES notation for 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole?

The canonical SMILES for 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole is c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6cccc(-c7ccc(-c8cc(-c9cccc(-n%10c%11ccc(-c%12cccc%13c%12c%12ccccc%12n%13-c%12ccccc%12)cc%11c%11cccnc%11%10)c9)cc(-c9ccccn9)n8)nc7)c6)cc5c5cccnc54)c3)n2)cc1.

What is the InChIKey of 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole?

The InChIKey is TYWDYHRLVVSRLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C101H63N11/c1-4-23-64(24-5-1)87-62-88(65-25-6-2-7-26-65)108-99(107-87)70-29-18-34-76(57-70)112-94-51-48-69(59-84(94)80-40-22-54-104-101(80)112)78-38-20-45-96-98(78)82-36-11-13-43-92(82)110(96)74-32-16-27-66(55-74)71-46-49-86(105-63-71)90-61-72(60-89(106-90)85-41-14-15-52-102-85)67-28-17-33-75(56-67)111-93-50-47-68(58-83(93)79-39-21-53-103-100(79)111)77-37-19-44-95-97(77)81-35-10-12-42-91(81)109(95)73-30-8-3-9-31-73/h1-63H.

What are the key properties of 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole?

9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole has a molecular weight of 1430.69 g/mol, XLogP of 24.84, 13 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole is sourced from PubChem (CID 163988969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).