10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine

C135H134N8O12 — CID 158635382

About 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine

10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine (PubChem CID 158635382) has the molecular formula C135H134N8O12 and a molecular weight of 2060.60 g/mol. Its IUPAC name is 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine.

Molecular Properties

• Compound Name: 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine
• PubChem CID: 158635382
• Molecular Formula: C135H134N8O12
• Molecular Weight: 2060.60 g/mol
• Exact Mass: 2059.01
• IUPAC Name: 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine
• SMILES: Cc1cc(C)c(N2c3ccc(C)cc3C=Cc3cc(C)oc32)c(C)c1.Cc1cc(C)c(N2c3ccc(C)cc3CCc3cc(C)oc32)c(C)c1.Cc1cc(C)c(N2c3ccc(C)cc3N=Nc3cc(C)oc32)c(C)c1.Cc1ccc2c(c1)C(=O)Oc1cc(C)oc1N2c1cccc2c1OCCC2.Cc1ccc2c(c1)CCCc1cc(C)oc1N2c1cccc2c1OCCC2.Cc1ccc2c(c1)COc1cc(C)oc1N2c1cccc2c1OCCC2
• InChI: InChI=1S/C24H25NO2.C23H25NO.C23H23NO.C22H19NO4.C22H21NO3.C21H21N3O/c1-16-11-12-21-19(14-16)7-3-8-20-15-17(2)27-24(20)25(21)22-10-4-6-18-9-5-13-26-23(18)22;2*1-14-6-9-21-19(12-14)7-8-20-13-18(5)25-23(20)24(21)22-16(3)10-15(2)11-17(22)4;1-13-8-9-17-16(11-13)22(24)27-19-12-14(2)26-21(19)23(17)18-7-3-5-15-6-4-10-25-20(15)18;1-14-8-9-18-17(11-14)13-25-20-12-15(2)26-22(20)23(18)19-7-3-5-16-6-4-10-24-21(16)19;1-12-6-7-19-17(10-12)22-23-18-11-16(5)25-21(18)24(19)20-14(3)8-13(2)9-15(20)4/h4,6,10-12,14-15H,3,5,7-9,13H2,1-2H3;6,9-13H,7-8H2,1-5H3;6-13H,1-5H3;3,5,7-9,11-12H,4,6,10H2,1-2H3;3,5,7-9,11-12H,4,6,10,13H2,1-2H3;6-11H,1-5H3
• InChIKey: HZSBLVVDWIENPF-UHFFFAOYSA-N
• XLogP: 37.17
• TPSA: 186.22 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 6
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2060.60
LogP ≤ 5	37.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The IUPAC name of 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine (CID 158635382) is 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine.

What is the SMILES notation for 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The canonical SMILES for 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine is Cc1cc(C)c(N2c3ccc(C)cc3C=Cc3cc(C)oc32)c(C)c1.Cc1cc(C)c(N2c3ccc(C)cc3CCc3cc(C)oc32)c(C)c1.Cc1cc(C)c(N2c3ccc(C)cc3N=Nc3cc(C)oc32)c(C)c1.Cc1ccc2c(c1)C(=O)Oc1cc(C)oc1N2c1cccc2c1OCCC2.Cc1ccc2c(c1)CCCc1cc(C)oc1N2c1cccc2c1OCCC2.Cc1ccc2c(c1)COc1cc(C)oc1N2c1cccc2c1OCCC2.

What is the InChIKey of 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The InChIKey is HZSBLVVDWIENPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2.C23H25NO.C23H23NO.C22H19NO4.C22H21NO3.C21H21N3O/c1-16-11-12-21-19(14-16)7-3-8-20-15-17(2)27-24(20)25(21)22-10-4-6-18-9-5-13-26-23(18)22;2*1-14-6-9-21-19(12-14)7-8-20-13-18(5)25-23(20)24(21)22-16(3)10-15(2)11-17(22)4;1-13-8-9-17-16(11-13)22(24)27-19-12-14(2)26-21(19)23(17)18-7-3-5-15-6-4-10-25-20(15)18;1-14-8-9-18-17(11-14)13-25-20-12-15(2)26-22(20)23(18)19-7-3-5-16-6-4-10-24-21(16)19;1-12-6-7-19-17(10-12)22-23-18-11-16(5)25-21(18)24(19)20-14(3)8-13(2)9-15(20)4/h4,6,10-12,14-15H,3,5,7-9,13H2,1-2H3;6,9-13H,7-8H2,1-5H3;6-13H,1-5H3;3,5,7-9,11-12H,4,6,10H2,1-2H3;3,5,7-9,11-12H,4,6,10,13H2,1-2H3;6-11H,1-5H3.

What are the key properties of 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine has a molecular weight of 2060.60 g/mol, XLogP of 37.17, 6 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(3,4-dihydro-2H-chromen-8-yl)-2,7-dimethylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(3,4-dihydro-2H-chromen-8-yl)-5,13-dimethyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(11),3(7),5,12,14-pentaene;2,7-dimethyl-10-(2,4,6-trimethylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[2,3-b][1]benzazepine;2,7-dimethyl-10-(2,4,6-trimethylphenyl)furo[3,2-c][1,2,5]benzotriazepine is sourced from PubChem (CID 158635382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).