10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene

C46H32N2O4 — CID 163448314

About 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene

10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene (PubChem CID 163448314) has the molecular formula C46H32N2O4 and a molecular weight of 676.77 g/mol. Its IUPAC name is 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene.

Molecular Properties

• Compound Name: 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene
• PubChem CID: 163448314
• Molecular Formula: C46H32N2O4
• Molecular Weight: 676.77 g/mol
• Exact Mass: 676.24
• IUPAC Name: 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene
• SMILES: Cc1cc2c(cc1C)N(c1ccccc1)c1cc3oc4cc5c(cc4c3cc1O2)oc1cc2c(cc15)Oc1cc(C)c(C)cc1N2c1ccccc1
• InChI: InChI=1S/C46H32N2O4/c1-25-15-35-43(17-27(25)3)51-45-21-33-31-19-40-32(20-39(31)49-41(33)23-37(45)47(35)29-11-7-5-8-12-29)34-22-46-38(24-42(34)50-40)48(30-13-9-6-10-14-30)36-16-26(2)28(4)18-44(36)52-46/h5-24H,1-4H3
• InChIKey: BEKKTPCQVLPAFS-UHFFFAOYSA-N
• XLogP: 13.87
• TPSA: 51.22 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 52
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	676.77
LogP ≤ 5	13.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene?

The IUPAC name of 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene (CID 163448314) is 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene.

What is the SMILES notation for 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene?

The canonical SMILES for 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene is Cc1cc2c(cc1C)N(c1ccccc1)c1cc3oc4cc5c(cc4c3cc1O2)oc1cc2c(cc15)Oc1cc(C)c(C)cc1N2c1ccccc1.

What is the InChIKey of 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene?

The InChIKey is BEKKTPCQVLPAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32N2O4/c1-25-15-35-43(17-27(25)3)51-45-21-33-31-19-40-32(20-39(31)49-41(33)23-37(45)47(35)29-11-7-5-8-12-29)34-22-46-38(24-42(34)50-40)48(30-13-9-6-10-14-30)36-16-26(2)28(4)18-44(36)52-46/h5-24H,1-4H3.

What are the key properties of 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene?

10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene has a molecular weight of 676.77 g/mol, XLogP of 13.87, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 10,11,28,29-tetramethyl-14,32-diphenyl-7,18,25,36-tetraoxa-14,32-diazanonacyclo[19.15.0.03,19.04,17.06,15.08,13.022,35.024,33.026,31]hexatriaconta-1(21),2,4,6(15),8(13),9,11,16,19,22,24(33),26(31),27,29,34-pentadecaene is sourced from PubChem (CID 163448314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).