7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine

C220H152N20 — CID 158166054

IUPAC7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine
SMILESc1ccc(N(c2ccc3c(c2)c2cc(N(c4ccccc4)c4cccc5ccccc45)ccc2c2nccnc32)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c4nccnc4c3c2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2c2nccnc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4nccnc4c3c2)cc1.c1ccc2c(c1)CCc1ccccc1N2c1ccc2c(c1)c1cc(N3c4ccccc4CCc4ccccc43)ccc1c1nccnc21
InChIInChI=1S/2C48H32N4.C44H32N4.2C40H28N4/c1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-43(31-37)44-32-38(26-28-42(44)48-47(41)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-42-28-26-38(32-44(42)48-47(43(41)31-37)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-5-13-39-29(9-1)17-18-30-10-2-6-14-40(30)47(39)33-21-23-35-37(27-33)38-28-34(22-24-36(38)44-43(35)45-25-26-46-44)48-41-15-7-3-11-31(41)19-20-32-12-4-8-16-42(32)48;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-37(27-33)38-28-34(22-24-36(38)40-39(35)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-36-24-22-34(28-38(36)40-39(37(35)27-33)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32/h2*1-32H;1-16,21-28H,17-20H2;2*1-28H
InChIKeyFWVXAEIJXXAWNM-UHFFFAOYSA-N
MW3075.78 g/mol
LogP59.19
Rot. Bonds26

About 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine

7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine (PubChem CID 158166054) has the molecular formula C220H152N20 and a molecular weight of 3075.78 g/mol. Its IUPAC name is 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine.

Molecular Properties

Compound Name7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine
PubChem CID158166054
Molecular FormulaC220H152N20
Molecular Weight3075.78 g/mol
Exact Mass3073.25
IUPAC Name7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine
SMILESc1ccc(N(c2ccc3c(c2)c2cc(N(c4ccccc4)c4cccc5ccccc45)ccc2c2nccnc32)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c4nccnc4c3c2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2c2nccnc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4nccnc4c3c2)cc1.c1ccc2c(c1)CCc1ccccc1N2c1ccc2c(c1)c1cc(N3c4ccccc4CCc4ccccc43)ccc1c1nccnc21
InChIInChI=1S/2C48H32N4.C44H32N4.2C40H28N4/c1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-43(31-37)44-32-38(26-28-42(44)48-47(41)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-42-28-26-38(32-44(42)48-47(43(41)31-37)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-5-13-39-29(9-1)17-18-30-10-2-6-14-40(30)47(39)33-21-23-35-37(27-33)38-28-34(22-24-36(38)44-43(35)45-25-26-46-44)48-41-15-7-3-11-31(41)19-20-32-12-4-8-16-42(32)48;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-37(27-33)38-28-34(22-24-36(38)40-39(35)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-36-24-22-34(28-38(36)40-39(37(35)27-33)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32/h2*1-32H;1-16,21-28H,17-20H2;2*1-28H
InChIKeyFWVXAEIJXXAWNM-UHFFFAOYSA-N
XLogP59.19
TPSA161.30 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms240
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003075.78
LogP ≤ 559.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine 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

5,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-naphthalen-1-yl-3-phenylphenanthro[9,10-d]imidazole;7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;5,10-di(carbazol-9-yl)-2-naphthalen-1-ylphenanthro[9,10-d][1,3]oxazole;5,10-di(carbazol-9-yl)-2-naphthalen-1-yl-3-phenylphenanthro[9,10-d]imidazole;2-naphthalen-1-yl-5-N,10-N,3-triphenyl-5-N,10-N-bis[4-[4-(N-phenylanilino)phenyl]phenyl]phenanthro[9,10-d]imidazole-5,10-diamine;6-N,9-N,2-trinaphthalen-1-yl-6-N,9-N,3-triphenylphenanthro[9,10-d]imidazole-6,9-diamine
CID 158481598
methane;4-N-naphthalen-1-yl-1-N-[4-[4-[2-(N-naphthalen-1-ylanilino)-9H-acridin-10-yl]phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 160648870
6-[4-(N-naphthalen-1-ylanilino)phenyl]-N-phenyl-N-(4-phenylphenyl)-9-triphenylen-2-ylcarbazol-3-amine
CID 89492179
7-methyl-N-[4-[4-(N-[7-methyl-10-(4-methylphenyl)-9H-acridin-2-yl]anilino)phenyl]phenyl]-10-(4-methylphenyl)-N-phenyl-9H-acridin-2-amine;N-naphthalen-2-yl-N-[4-[4-[naphthalen-1-yl-(10-phenyl-9H-acridin-2-yl)amino]phenyl]phenyl]-10-phenyl-9H-acridin-2-amine;10-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(10-phenyl-9H-acridin-2-yl)anilino)phenyl]phenyl]-9H-acridin-2-amine
CID 158962449
2-N-naphthalen-1-yl-2-N-[4-[4-[naphthalen-1-yl-[7-(N-phenylanilino)phenanthren-2-yl]amino]phenyl]phenyl]-7-N,7-N-diphenylphenanthrene-2,7-diamine
CID 59754883
2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)phenanthrene-2,7-diamine
CID 59754864
1-N,9-N-dinaphthalen-2-yl-1-N,9-N-diphenylchrysene-1,9-diamine
CID 170410643
2-N-[7-(N-naphthalen-1-ylanilino)phenanthren-2-yl]-2-N,7-N-diphenyl-7-N-(4-phenylphenyl)phenanthrene-2,7-diamine
CID 59754912
N,N-diphenyl-9-(11-phenylphenanthro[9,10-b]pyrazin-6-yl)carbazol-3-amine
CID 118912220
4-N-naphthalen-2-yl-1-N-[4-(N-naphthalen-1-ylanilino)phenyl]-1-N-[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 58598982
7-(21,21-dimethyl-10-oxa-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl)-N-naphthalen-1-yl-N-phenylphenanthren-2-amine
CID 146213041
3-N,6-N-dinaphthalen-1-yl-3-N,6-N-diphenylchrysene-3,6-diamine
CID 170410600

Frequently Asked Questions

What is the IUPAC name of 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine?
The IUPAC name of 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine (CID 158166054) is 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine.
What is the SMILES notation for 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine?
The canonical SMILES for 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine is c1ccc(N(c2ccc3c(c2)c2cc(N(c4ccccc4)c4cccc5ccccc45)ccc2c2nccnc32)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c4nccnc4c3c2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2c2nccnc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4nccnc4c3c2)cc1.c1ccc2c(c1)CCc1ccccc1N2c1ccc2c(c1)c1cc(N3c4ccccc4CCc4ccccc43)ccc1c1nccnc21.
What is the InChIKey of 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine?
The InChIKey is FWVXAEIJXXAWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H32N4.C44H32N4.2C40H28N4/c1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-43(31-37)44-32-38(26-28-42(44)48-47(41)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-3-17-35(18-4-1)51(45-23-11-15-33-13-7-9-21-39(33)45)37-25-27-41-42-28-26-38(32-44(42)48-47(43(41)31-37)49-29-30-50-48)52(36-19-5-2-6-20-36)46-24-12-16-34-14-8-10-22-40(34)46;1-5-13-39-29(9-1)17-18-30-10-2-6-14-40(30)47(39)33-21-23-35-37(27-33)38-28-34(22-24-36(38)44-43(35)45-25-26-46-44)48-41-15-7-3-11-31(41)19-20-32-12-4-8-16-42(32)48;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-37(27-33)38-28-34(22-24-36(38)40-39(35)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32;1-5-13-29(14-6-1)43(30-15-7-2-8-16-30)33-21-23-35-36-24-22-34(28-38(36)40-39(37(35)27-33)41-25-26-42-40)44(31-17-9-3-10-18-31)32-19-11-4-12-20-32/h2*1-32H;1-16,21-28H,17-20H2;2*1-28H.
What are the key properties of 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine?
7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine has a molecular weight of 3075.78 g/mol, XLogP of 59.19, 26 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 7,10-bis(5,6-dihydrobenzo[b][1]benzazepin-11-yl)phenanthro[9,10-b]pyrazine;6-N,11-N-dinaphthalen-1-yl-6-N,11-N-diphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,10-N-dinaphthalen-1-yl-7-N,10-N-diphenylphenanthro[9,10-b]pyrazine-7,10-diamine;6-N,6-N,11-N,11-N-tetraphenylphenanthro[9,10-b]pyrazine-6,11-diamine;7-N,7-N,10-N,10-N-tetraphenylphenanthro[9,10-b]pyrazine-7,10-diamine is sourced from PubChem (CID 158166054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).