bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine

C140H145Br2Cl8N23 — CID 158789373

About bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine

bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine (PubChem CID 158789373) has the molecular formula C140H145Br2Cl8N23 and a molecular weight of 2593.29 g/mol. Its IUPAC name is bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine.

Molecular Properties

• Compound Name: bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine
• PubChem CID: 158789373
• Molecular Formula: C140H145Br2Cl8N23
• Molecular Weight: 2593.29 g/mol
• Exact Mass: 2585.79
• IUPAC Name: bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine
• SMILES: CCN(CC)CCCC(C)Nc1nc(-c2ccc3cc(Cl)c(Cl)cc3c2)nc2c(C)cccc12.CCN(CC)CCCC(C)Nc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Cl)cccc12.CN(C)CCCNc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Br)cccc12.CN(C)CCCNc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Br)cccc12.Cc1cccc2c(NCCCN(C)C)nc(-c3ccc4cc(Cl)c(Cl)cc4c3)nc12
• InChI: InChI=1S/C32H35Cl2N5.2C28H27BrClN5.C28H32Cl2N4.C24H24Cl2N4/c1-4-38(5-2)19-11-12-22(3)35-31-25-16-10-17-27(33)29(25)36-32(37-31)26-21-39(20-23-13-7-6-8-14-23)30-24(26)15-9-18-28(30)34;2*1-34(2)16-8-15-31-27-21-12-6-13-23(29)25(21)32-28(33-27)22-18-35(17-19-9-4-3-5-10-19)26-20(22)11-7-14-24(26)30;1-5-34(6-2)14-8-10-19(4)31-28-23-11-7-9-18(3)26(23)32-27(33-28)21-13-12-20-16-24(29)25(30)17-22(20)15-21;1-15-6-4-7-19-22(15)28-23(29-24(19)27-10-5-11-30(2)3)17-9-8-16-13-20(25)21(26)14-18(16)12-17/h6-10,13-18,21-22H,4-5,11-12,19-20H2,1-3H3,(H,35,36,37);2*3-7,9-14,18H,8,15-17H2,1-2H3,(H,31,32,33);7,9,11-13,15-17,19H,5-6,8,10,14H2,1-4H3,(H,31,32,33);4,6-9,12-14H,5,10-11H2,1-3H3,(H,27,28,29)
• InChIKey: ISBRFBGXVHKPNL-UHFFFAOYSA-N
• XLogP: 37.10
• TPSA: 220.04 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 42
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2593.29
LogP ≤ 5	37.10
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine?

The IUPAC name of bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine (CID 158789373) is bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine.

What is the SMILES notation for bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine?

The canonical SMILES for bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine is CCN(CC)CCCC(C)Nc1nc(-c2ccc3cc(Cl)c(Cl)cc3c2)nc2c(C)cccc12.CCN(CC)CCCC(C)Nc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Cl)cccc12.CN(C)CCCNc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Br)cccc12.CN(C)CCCNc1nc(-c2cn(Cc3ccccc3)c3c(Cl)cccc23)nc2c(Br)cccc12.Cc1cccc2c(NCCCN(C)C)nc(-c3ccc4cc(Cl)c(Cl)cc4c3)nc12.

What is the InChIKey of bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine?

The InChIKey is ISBRFBGXVHKPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H35Cl2N5.2C28H27BrClN5.C28H32Cl2N4.C24H24Cl2N4/c1-4-38(5-2)19-11-12-22(3)35-31-25-16-10-17-27(33)29(25)36-32(37-31)26-21-39(20-23-13-7-6-8-14-23)30-24(26)15-9-18-28(30)34;2*1-34(2)16-8-15-31-27-21-12-6-13-23(29)25(21)32-28(33-27)22-18-35(17-19-9-4-3-5-10-19)26-20(22)11-7-14-24(26)30;1-5-34(6-2)14-8-10-19(4)31-28-23-11-7-9-18(3)26(23)32-27(33-28)21-13-12-20-16-24(29)25(30)17-22(20)15-21;1-15-6-4-7-19-22(15)28-23(29-24(19)27-10-5-11-30(2)3)17-9-8-16-13-20(25)21(26)14-18(16)12-17/h6-10,13-18,21-22H,4-5,11-12,19-20H2,1-3H3,(H,35,36,37);2*3-7,9-14,18H,8,15-17H2,1-2H3,(H,31,32,33);7,9,11-13,15-17,19H,5-6,8,10,14H2,1-4H3,(H,31,32,33);4,6-9,12-14H,5,10-11H2,1-3H3,(H,27,28,29).

What are the key properties of bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine?

bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine has a molecular weight of 2593.29 g/mol, XLogP of 37.10, 42 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for bis(N-[2-(1-benzyl-7-chloroindol-3-yl)-8-bromoquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine);4-N-[2-(1-benzyl-7-chloroindol-3-yl)-8-chloroquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;4-N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine;N-[2-(6,7-dichloronaphthalen-2-yl)-8-methylquinazolin-4-yl]-N',N'-dimethylpropane-1,3-diamine is sourced from PubChem (CID 158789373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).