7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine

C144H99Cl13N30O — CID 159440429

About 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine

7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine (PubChem CID 159440429) has the molecular formula C144H99Cl13N30O and a molecular weight of 2726.47 g/mol. Its IUPAC name is 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine.

Molecular Properties

• Compound Name: 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine
• PubChem CID: 159440429
• Molecular Formula: C144H99Cl13N30O
• Molecular Weight: 2726.47 g/mol
• Exact Mass: 2718.46
• IUPAC Name: 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine
• SMILES: Cn1cncc1C(Cl)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(-c1ccccc1)c1nnnn12.Cn1cncc1C(Cl)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1cnnn12.Cn1cncc1C(N)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(-c1ccccc1)c1nnnn12.Cn1cncc1C(N)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1cnnn12.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(Cl)c1nnnn12
• InChI: InChI=1S/C32H21Cl3N6.C32H23Cl2N7.C27H18Cl3N5.C27H20Cl2N6.C26H17Cl3N6O/c2*1-40-19-36-18-28(40)32(35,22-10-13-24(33)14-11-22)23-12-15-27-26(17-23)29(21-8-5-9-25(34)16-21)30(20-6-3-2-4-7-20)31-37-38-39-41(27)31;2*1-34-16-31-15-26(34)27(30,18-5-8-20(28)9-6-18)19-7-10-25-24(12-19)23(13-22-14-32-33-35(22)25)17-3-2-4-21(29)11-17;1-34-14-30-13-22(34)26(36,16-5-8-18(27)9-6-16)17-7-10-21-20(12-17)23(15-3-2-4-19(28)11-15)24(29)25-31-32-33-35(21)25/h2-19H,1H3;2-19H,35H2,1H3;2-16H,1H3;2-16H,30H2,1H3;2-14,36H,1H3
• InChIKey: LSCHTSFGICPIGR-UHFFFAOYSA-N
• XLogP: 33.97
• TPSA: 350.99 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 31
• Rotatable Bonds: 22
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2726.47
LogP ≤ 5	33.97
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine?

The IUPAC name of 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine (CID 159440429) is 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine.

What is the SMILES notation for 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine?

The canonical SMILES for 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine is Cn1cncc1C(Cl)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(-c1ccccc1)c1nnnn12.Cn1cncc1C(Cl)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1cnnn12.Cn1cncc1C(N)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(-c1ccccc1)c1nnnn12.Cn1cncc1C(N)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1cnnn12.Cn1cncc1C(O)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)c(Cl)c1nnnn12.

What is the InChIKey of 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine?

The InChIKey is LSCHTSFGICPIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21Cl3N6.C32H23Cl2N7.C27H18Cl3N5.C27H20Cl2N6.C26H17Cl3N6O/c2*1-40-19-36-18-28(40)32(35,22-10-13-24(33)14-11-22)23-12-15-27-26(17-23)29(21-8-5-9-25(34)16-21)30(20-6-3-2-4-7-20)31-37-38-39-41(27)31;2*1-34-16-31-15-26(34)27(30,18-5-8-20(28)9-6-18)19-7-10-25-24(12-19)23(13-22-14-32-33-35(22)25)17-3-2-4-21(29)11-17;1-34-14-30-13-22(34)26(36,16-5-8-18(27)9-6-16)17-7-10-21-20(12-17)23(15-3-2-4-19(28)11-15)24(29)25-31-32-33-35(21)25/h2-19H,1H3;2-19H,35H2,1H3;2-16H,1H3;2-16H,30H2,1H3;2-14,36H,1H3.

What are the key properties of 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine?

7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine has a molecular weight of 2726.47 g/mol, XLogP of 33.97, 22 rotatable bonds, 3 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinoline;7-[chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)triazolo[1,5-a]quinoline;[4-chloro-5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-phenyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine;(4-chlorophenyl)-[5-(3-chlorophenyl)triazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanamine is sourced from PubChem (CID 159440429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).