15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene

C147H89N9O3 — CID 159376576

About 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene

15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene (PubChem CID 159376576) has the molecular formula C147H89N9O3 and a molecular weight of 2029.39 g/mol. Its IUPAC name is 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene.

Molecular Properties

• Compound Name: 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene
• PubChem CID: 159376576
• Molecular Formula: C147H89N9O3
• Molecular Weight: 2029.39 g/mol
• Exact Mass: 2027.71
• IUPAC Name: 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene
• SMILES: c1ccc(-c2cc(-c3ccc(-n4c5cc6c(cc5c5ccc7c8ccccc8oc7c54)c4ccccc4n6-c4ccccc4)cc3)nc3ccccc23)cc1.c1ccc(-c2cc(-c3cccc(-n4c5cc6c(cc5c5ccc7c8ccccc8oc7c54)c4ccccc4n6-c4ccccc4)c3)nc3ccccc23)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc5c6ccc7c8ccccc8oc7c6n(-c6ccccc6)c5cc43)nc3ccccc23)cc1
• InChI: InChI=1S/2C51H31N3O.C45H27N3O/c1-3-14-32(15-4-1)41-30-45(52-44-23-10-7-20-36(41)44)33-16-13-19-35(28-33)54-48-31-47-42(37-21-8-11-24-46(37)53(47)34-17-5-2-6-18-34)29-43(48)39-26-27-40-38-22-9-12-25-49(38)55-51(40)50(39)54;1-3-13-32(14-4-1)41-30-45(52-44-20-10-7-17-36(41)44)33-23-25-35(26-24-33)54-48-31-47-42(37-18-8-11-21-46(37)53(47)34-15-5-2-6-16-34)29-43(48)39-27-28-40-38-19-9-12-22-49(38)55-51(40)50(39)54;1-3-13-28(14-4-1)35-26-43(46-38-20-10-7-17-30(35)38)48-39-21-11-8-18-31(39)36-25-37-33-23-24-34-32-19-9-12-22-42(32)49-45(34)44(33)47(40(37)27-41(36)48)29-15-5-2-6-16-29/h2*1-31H;1-27H
• InChIKey: LKJSTWURVZEANO-UHFFFAOYSA-N
• XLogP: 39.32
• TPSA: 107.67 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 11
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2029.39
LogP ≤ 5	39.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene?

The IUPAC name of 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene (CID 159376576) is 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene.

What is the SMILES notation for 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene?

The canonical SMILES for 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene is c1ccc(-c2cc(-c3ccc(-n4c5cc6c(cc5c5ccc7c8ccccc8oc7c54)c4ccccc4n6-c4ccccc4)cc3)nc3ccccc23)cc1.c1ccc(-c2cc(-c3cccc(-n4c5cc6c(cc5c5ccc7c8ccccc8oc7c54)c4ccccc4n6-c4ccccc4)c3)nc3ccccc23)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc5c6ccc7c8ccccc8oc7c6n(-c6ccccc6)c5cc43)nc3ccccc23)cc1.

What is the InChIKey of 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene?

The InChIKey is LKJSTWURVZEANO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H31N3O.C45H27N3O/c1-3-14-32(15-4-1)41-30-45(52-44-23-10-7-20-36(41)44)33-16-13-19-35(28-33)54-48-31-47-42(37-21-8-11-24-46(37)53(47)34-17-5-2-6-18-34)29-43(48)39-26-27-40-38-22-9-12-25-49(38)55-51(40)50(39)54;1-3-13-32(14-4-1)41-30-45(52-44-20-10-7-17-36(41)44)33-23-25-35(26-24-33)54-48-31-47-42(37-18-8-11-21-46(37)53(47)34-15-5-2-6-16-34)29-43(48)39-27-28-40-38-19-9-12-22-49(38)55-51(40)50(39)54;1-3-13-28(14-4-1)35-26-43(46-38-20-10-7-17-30(35)38)48-39-21-11-8-18-31(39)36-25-37-33-23-24-34-32-19-9-12-22-42(32)49-45(34)44(33)47(40(37)27-41(36)48)29-15-5-2-6-16-29/h2*1-31H;1-27H.

What are the key properties of 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene?

15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene has a molecular weight of 2029.39 g/mol, XLogP of 39.32, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 15-phenyl-11-(4-phenylquinolin-2-yl)-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[3-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;11-phenyl-15-[4-(4-phenylquinolin-2-yl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene is sourced from PubChem (CID 159376576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).