4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine

C156H144Cl5N41O3 — CID 159282497

About 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine

4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine (PubChem CID 159282497) has the molecular formula C156H144Cl5N41O3 and a molecular weight of 2818.42 g/mol. Its IUPAC name is 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine.

Molecular Properties

• Compound Name: 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine
• PubChem CID: 159282497
• Molecular Formula: C156H144Cl5N41O3
• Molecular Weight: 2818.42 g/mol
• Exact Mass: 2814.08
• IUPAC Name: 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine
• SMILES: COc1cc(C)c2c(Cl)ccnc2c1.COc1cc2nccc(Cl)c2cc1C.COc1ccc2c(Cl)ccnc2c1C.Cc1cc(C)c2ncccc2c1.Cc1ccc(C)c2ncccc12.Cc1ccc2cccnc2c1C.Cc1ccc2cnnnc2c1.Cc1ccc2nc(CCl)nc(C)c2c1.Cc1ccc2nnncc2c1.Cc1ccc2nnnnc2c1.Cc1ccc2nnnnc2c1.Cc1cccc2cnnnc12.Cc1cccc2nc(CCl)nc(C)c12.Cc1cccc2nncnc12.Cc1cccc2nnncc12.Cc1cccc2nnnnc12.Cc1cccc2nnnnc12
• InChI: InChI=1S/2C11H11ClN2.3C11H10ClNO.3C11H11N.5C8H7N3.4C7H6N4/c1-7-3-4-10-9(5-7)8(2)13-11(6-12)14-10;1-7-4-3-5-9-11(7)8(2)13-10(6-12)14-9;1-7-5-8-9(12)3-4-13-10(8)6-11(7)14-2;1-7-5-8(14-2)6-10-11(7)9(12)3-4-13-10;1-7-10(14-2)4-3-8-9(12)5-6-13-11(7)8;1-8-5-6-10-4-3-7-12-11(10)9(8)2;1-8-5-6-9(2)11-10(8)4-3-7-12-11;1-8-6-9(2)11-10(7-8)4-3-5-12-11;1-6-2-3-8-7(4-6)5-9-11-10-8;1-6-2-3-7-5-9-11-10-8(7)4-6;1-6-3-2-4-8-7(6)5-9-11-10-8;1-6-3-2-4-7-8(6)9-5-10-11-7;1-6-3-2-4-7-5-9-11-10-8(6)7;2*1-5-2-3-6-7(4-5)9-11-10-8-6;2*1-5-3-2-4-6-7(5)9-11-10-8-6/h2*3-5H,6H2,1-2H3;3*3-6H,1-2H3;3*3-7H,1-2H3;5*2-5H,1H3;4*2-4H,1H3
• InChIKey: KZCFUXAVBBOFLB-UHFFFAOYSA-N
• XLogP: 33.72
• TPSA: 556.18 Ų
• H-Bond Acceptors: 44
• Rotatable Bonds: 5
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2818.42
LogP ≤ 5	33.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	44

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine?

The IUPAC name of 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine (CID 159282497) is 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine.

What is the SMILES notation for 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine?

The canonical SMILES for 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine is COc1cc(C)c2c(Cl)ccnc2c1.COc1cc2nccc(Cl)c2cc1C.COc1ccc2c(Cl)ccnc2c1C.Cc1cc(C)c2ncccc2c1.Cc1ccc(C)c2ncccc12.Cc1ccc2cccnc2c1C.Cc1ccc2cnnnc2c1.Cc1ccc2nc(CCl)nc(C)c2c1.Cc1ccc2nnncc2c1.Cc1ccc2nnnnc2c1.Cc1ccc2nnnnc2c1.Cc1cccc2cnnnc12.Cc1cccc2nc(CCl)nc(C)c12.Cc1cccc2nncnc12.Cc1cccc2nnncc12.Cc1cccc2nnnnc12.Cc1cccc2nnnnc12.

What is the InChIKey of 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine?

The InChIKey is KZCFUXAVBBOFLB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H11ClN2.3C11H10ClNO.3C11H11N.5C8H7N3.4C7H6N4/c1-7-3-4-10-9(5-7)8(2)13-11(6-12)14-10;1-7-4-3-5-9-11(7)8(2)13-10(6-12)14-9;1-7-5-8-9(12)3-4-13-10(8)6-11(7)14-2;1-7-5-8(14-2)6-10-11(7)9(12)3-4-13-10;1-7-10(14-2)4-3-8-9(12)5-6-13-11(7)8;1-8-5-6-10-4-3-7-12-11(10)9(8)2;1-8-5-6-9(2)11-10(8)4-3-7-12-11;1-8-6-9(2)11-10(7-8)4-3-5-12-11;1-6-2-3-8-7(4-6)5-9-11-10-8;1-6-2-3-7-5-9-11-10-8(7)4-6;1-6-3-2-4-8-7(6)5-9-11-10-8;1-6-3-2-4-7-8(6)9-5-10-11-7;1-6-3-2-4-7-5-9-11-10-8(6)7;2*1-5-2-3-6-7(4-5)9-11-10-8-6;2*1-5-3-2-4-6-7(5)9-11-10-8-6/h2*3-5H,6H2,1-2H3;3*3-6H,1-2H3;3*3-7H,1-2H3;5*2-5H,1H3;4*2-4H,1H3.

What are the key properties of 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine?

4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine has a molecular weight of 2818.42 g/mol, XLogP of 33.72, 5 rotatable bonds, 0 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-7-methoxy-5-methylquinoline;4-chloro-7-methoxy-6-methylquinoline;4-chloro-7-methoxy-8-methylquinoline;2-(chloromethyl)-4,5-dimethylquinazoline;2-(chloromethyl)-4,6-dimethylquinazoline;5,8-dimethylquinoline;6,8-dimethylquinoline;7,8-dimethylquinoline;bis(5-methyl-1,2,3,4-benzotetrazine);bis(6-methyl-1,2,3,4-benzotetrazine);5-methyl-1,2,3-benzotriazine;5-methyl-1,2,4-benzotriazine;6-methyl-1,2,3-benzotriazine;7-methyl-1,2,3-benzotriazine;8-methyl-1,2,3-benzotriazine is sourced from PubChem (CID 159282497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).