9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole

C158H168N6 — CID 158360719

IUPAC9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole
SMILESCC1(C)c2cc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)C(C)(C)C8(C)C)cc5)cc4)c3cc2C(C)(C)C1(C)C.CC1(C)c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6cc7c(cc65)C(C)(C)C(C)(C)C7(C)C)c4)c3cc2C(C)(C)C1(C)C.Cc1cc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)ccc1-c1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)cc1C
InChIInChI=1S/C56H60N2.C54H56N2.C48H52N2/c1-33-27-35(57-47-21-17-15-19-39(47)41-29-43-45(31-49(41)57)53(7,8)55(11,12)51(43,3)4)23-25-37(33)38-26-24-36(28-34(38)2)58-48-22-18-16-20-40(48)42-30-44-46(32-50(42)58)54(9,10)56(13,14)52(44,5)6;1-49(2)41-29-39-37-17-13-15-19-45(37)55(47(39)31-43(41)51(5,6)53(49,9)10)35-25-21-33(22-26-35)34-23-27-36(28-24-34)56-46-20-16-14-18-38(46)40-30-42-44(32-48(40)56)52(7,8)54(11,12)50(42,3)4;1-43(2)35-25-33-31-20-13-15-22-39(31)49(41(33)27-37(35)45(5,6)47(43,9)10)29-18-17-19-30(24-29)50-40-23-16-14-21-32(40)34-26-36-38(28-42(34)50)46(7,8)48(11,12)44(36,3)4/h15-32H,1-14H3;13-32H,1-12H3;13-28H,1-12H3
InChIKeyGTKYKMXKFDXZDN-UHFFFAOYSA-N
MW2151.12 g/mol
LogP43.16
Rot. Bonds8

About 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole

9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole (PubChem CID 158360719) has the molecular formula C158H168N6 and a molecular weight of 2151.12 g/mol. Its IUPAC name is 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole.

Molecular Properties

Compound Name9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole
PubChem CID158360719
Molecular FormulaC158H168N6
Molecular Weight2151.12 g/mol
Exact Mass2149.33
IUPAC Name9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole
SMILESCC1(C)c2cc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)C(C)(C)C8(C)C)cc5)cc4)c3cc2C(C)(C)C1(C)C.CC1(C)c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6cc7c(cc65)C(C)(C)C(C)(C)C7(C)C)c4)c3cc2C(C)(C)C1(C)C.Cc1cc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)ccc1-c1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)cc1C
InChIInChI=1S/C56H60N2.C54H56N2.C48H52N2/c1-33-27-35(57-47-21-17-15-19-39(47)41-29-43-45(31-49(41)57)53(7,8)55(11,12)51(43,3)4)23-25-37(33)38-26-24-36(28-34(38)2)58-48-22-18-16-20-40(48)42-30-44-46(32-50(42)58)54(9,10)56(13,14)52(44,5)6;1-49(2)41-29-39-37-17-13-15-19-45(37)55(47(39)31-43(41)51(5,6)53(49,9)10)35-25-21-33(22-26-35)34-23-27-36(28-24-34)56-46-20-16-14-18-38(46)40-30-42-44(32-48(40)56)52(7,8)54(11,12)50(42,3)4;1-43(2)35-25-33-31-20-13-15-22-39(31)49(41(33)27-37(35)45(5,6)47(43,9)10)29-18-17-19-30(24-29)50-40-23-16-14-21-32(40)34-26-36-38(28-42(34)50)46(7,8)48(11,12)44(36,3)4/h15-32H,1-14H3;13-32H,1-12H3;13-28H,1-12H3
InChIKeyGTKYKMXKFDXZDN-UHFFFAOYSA-N
XLogP43.16
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms164
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002151.12
LogP ≤ 543.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole?
The IUPAC name of 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole (CID 158360719) is 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole.
What is the SMILES notation for 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole?
The canonical SMILES for 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole is CC1(C)c2cc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)C(C)(C)C8(C)C)cc5)cc4)c3cc2C(C)(C)C1(C)C.CC1(C)c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6cc7c(cc65)C(C)(C)C(C)(C)C7(C)C)c4)c3cc2C(C)(C)C1(C)C.Cc1cc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)ccc1-c1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C(C)(C)C4(C)C)cc1C.
What is the InChIKey of 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole?
The InChIKey is GTKYKMXKFDXZDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H60N2.C54H56N2.C48H52N2/c1-33-27-35(57-47-21-17-15-19-39(47)41-29-43-45(31-49(41)57)53(7,8)55(11,12)51(43,3)4)23-25-37(33)38-26-24-36(28-34(38)2)58-48-22-18-16-20-40(48)42-30-44-46(32-50(42)58)54(9,10)56(13,14)52(44,5)6;1-49(2)41-29-39-37-17-13-15-19-45(37)55(47(39)31-43(41)51(5,6)53(49,9)10)35-25-21-33(22-26-35)34-23-27-36(28-24-34)56-46-20-16-14-18-38(46)40-30-42-44(32-48(40)56)52(7,8)54(11,12)50(42,3)4;1-43(2)35-25-33-31-20-13-15-22-39(31)49(41(33)27-37(35)45(5,6)47(43,9)10)29-18-17-19-30(24-29)50-40-23-16-14-21-32(40)34-26-36-38(28-42(34)50)46(7,8)48(11,12)44(36,3)4/h15-32H,1-14H3;13-32H,1-12H3;13-28H,1-12H3.
What are the key properties of 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole?
9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole has a molecular weight of 2151.12 g/mol, XLogP of 43.16, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)-2-methylphenyl]-3-methylphenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[3-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole;9-[4-[4-(1,1,2,2,3,3-hexamethylcyclopenta[b]carbazol-9-yl)phenyl]phenyl]-1,1,2,2,3,3-hexamethylcyclopenta[b]carbazole is sourced from PubChem (CID 158360719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).