19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene

C170H117N17O5 — CID 157094432

About 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene

19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene (PubChem CID 157094432) has the molecular formula C170H117N17O5 and a molecular weight of 2477.92 g/mol. Its IUPAC name is 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene.

Molecular Properties

• Compound Name: 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene
• PubChem CID: 157094432
• Molecular Formula: C170H117N17O5
• Molecular Weight: 2477.92 g/mol
• Exact Mass: 2475.94
• IUPAC Name: 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene
• SMILES: CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3ccc4c(c3)nc3c5ccccc5c5ccccc5n43)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3ccc4nc5c6ccccc6c6ccccc6n5c4c3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3cccc(-c4ccncc4)n3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3nc(-c4ccccc4)nc(-c4ccncc4)n3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3nc4ccccc4n3-c3ccccc3)c21
• InChI: InChI=1S/2C38H25N3O.C33H23N5O.C32H23N3O.C29H21N3O/c1-38(2)28-16-8-5-14-26(28)33-34-35(42-36(33)38)27-15-7-10-18-31(27)40(34)22-19-20-32-29(21-22)39-37-25-13-4-3-11-23(25)24-12-6-9-17-30(24)41(32)37;1-38(2)28-16-8-5-14-26(28)33-34-35(42-36(33)38)27-15-7-10-18-31(27)40(34)22-19-20-29-32(21-22)41-30-17-9-6-12-24(30)23-11-3-4-13-25(23)37(41)39-29;1-33(2)24-14-8-6-12-22(24)26-27-28(39-29(26)33)23-13-7-9-15-25(23)38(27)32-36-30(20-10-4-3-5-11-20)35-31(37-32)21-16-18-34-19-17-21;1-32(2)23-16-8-6-14-21(23)27-28-29(36-30(27)32)22-15-7-10-18-25(22)35(28)31-33-24-17-9-11-19-26(24)34(31)20-12-4-3-5-13-20;1-29(2)21-10-5-3-8-19(21)25-26-27(33-28(25)29)20-9-4-6-12-23(20)32(26)24-13-7-11-22(31-24)18-14-16-30-17-15-18/h2*3-21H,1-2H3;3-19H,1-2H3;3-19H,1-2H3;3-17H,1-2H3
• InChIKey: AFASUSPQVTZJDK-UHFFFAOYSA-N
• XLogP: 42.34
• TPSA: 220.11 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 9
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2477.92
LogP ≤ 5	42.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene?

The IUPAC name of 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene (CID 157094432) is 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene.

What is the SMILES notation for 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene?

The canonical SMILES for 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene is CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3ccc4c(c3)nc3c5ccccc5c5ccccc5n43)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3ccc4nc5c6ccccc6c6ccccc6n5c4c3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3cccc(-c4ccncc4)n3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3nc(-c4ccccc4)nc(-c4ccncc4)n3)c21.CC1(C)c2ccccc2-c2c1oc1c3ccccc3n(-c3nc4ccccc4n3-c3ccccc3)c21.

What is the InChIKey of 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene?

The InChIKey is AFASUSPQVTZJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C38H25N3O.C33H23N5O.C32H23N3O.C29H21N3O/c1-38(2)28-16-8-5-14-26(28)33-34-35(42-36(33)38)27-15-7-10-18-31(27)40(34)22-19-20-32-29(21-22)39-37-25-13-4-3-11-23(25)24-12-6-9-17-30(24)41(32)37;1-38(2)28-16-8-5-14-26(28)33-34-35(42-36(33)38)27-15-7-10-18-31(27)40(34)22-19-20-29-32(21-22)41-30-17-9-6-12-24(30)23-11-3-4-13-25(23)37(41)39-29;1-33(2)24-14-8-6-12-22(24)26-27-28(39-29(26)33)23-13-7-9-15-25(23)38(27)32-36-30(20-10-4-3-5-11-20)35-31(37-32)21-16-18-34-19-17-21;1-32(2)23-16-8-6-14-21(23)27-28-29(36-30(27)32)22-15-7-10-18-25(22)35(28)31-33-24-17-9-11-19-26(24)34(31)20-12-4-3-5-13-20;1-29(2)21-10-5-3-8-19(21)25-26-27(33-28(25)29)20-9-4-6-12-23(20)32(26)24-13-7-11-22(31-24)18-14-16-30-17-15-18/h2*3-21H,1-2H3;3-19H,1-2H3;3-19H,1-2H3;3-17H,1-2H3.

What are the key properties of 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene?

19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene has a molecular weight of 2477.92 g/mol, XLogP of 42.34, 9 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-17-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;19-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaen-18-yl)-9,9-dimethyl-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(1-phenylbenzimidazol-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene;9,9-dimethyl-19-(6-pyridin-4-yl-2-pyridinyl)-11-oxa-19-azapentacyclo[10.7.0.02,10.03,8.013,18]nonadeca-1(12),2(10),3,5,7,13,15,17-octaene is sourced from PubChem (CID 157094432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).