1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline

C130H103Cl5F2N20O8 — CID 173105525

IUPAC1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline
SMILESCNC(=O)Nc1cccc(C(Oc2ccc3c(c2)nc(C)c2c(C)ncn23)c2ccccc2Cl)c1.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3c(F)cccc3F)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3ccc4ccccc4n3)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3cccc([N+](=O)[O-])c3)ccc12.Cc1ncn2c1c(C)nc1cc(OC(c3cccc(N)c3)c3ccccc3Cl)ccc12
InChIInChI=1S/C28H21ClN4O.C27H24ClN5O2.C25H18ClF2N3O.C25H19ClN4O3.C25H21ClN4O/c1-17-27-18(2)31-28(22-8-4-5-9-23(22)29)33(27)26-14-13-21(15-25(26)30-17)34-16-20-12-11-19-7-3-6-10-24(19)32-20;1-16-25-17(2)31-23-14-20(11-12-24(23)33(25)15-30-16)35-26(21-9-4-5-10-22(21)28)18-7-6-8-19(13-18)32-27(34)29-3;1-14-24-15(2)30-25(17-6-3-4-7-19(17)26)31(24)23-11-10-16(12-22(23)29-14)32-13-18-20(27)8-5-9-21(18)28;1-15-24-16(2)28-25(20-8-3-4-9-21(20)26)29(24)23-11-10-19(13-22(23)27-15)33-14-17-6-5-7-18(12-17)30(31)32;1-15-24-16(2)29-22-13-19(10-11-23(22)30(24)14-28-15)31-25(17-6-5-7-18(27)12-17)20-8-3-4-9-21(20)26/h3-15H,16H2,1-2H3;4-15,26H,1-3H3,(H2,29,32,34);3-12H,13H2,1-2H3;3-13H,14H2,1-2H3;3-14,25H,27H2,1-2H3
InChIKeyYQNBTRDBYJKUHY-UHFFFAOYSA-N
MW2288.65 g/mol
LogP31.91
Rot. Bonds22

About 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline

1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline (PubChem CID 173105525) has the molecular formula C130H103Cl5F2N20O8 and a molecular weight of 2288.65 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline.

Molecular Properties

Compound Name1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline
PubChem CID173105525
Molecular FormulaC130H103Cl5F2N20O8
Molecular Weight2288.65 g/mol
Exact Mass2284.67
IUPAC Name1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline
SMILESCNC(=O)Nc1cccc(C(Oc2ccc3c(c2)nc(C)c2c(C)ncn23)c2ccccc2Cl)c1.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3c(F)cccc3F)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3ccc4ccccc4n3)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3cccc([N+](=O)[O-])c3)ccc12.Cc1ncn2c1c(C)nc1cc(OC(c3cccc(N)c3)c3ccccc3Cl)ccc12
InChIInChI=1S/C28H21ClN4O.C27H24ClN5O2.C25H18ClF2N3O.C25H19ClN4O3.C25H21ClN4O/c1-17-27-18(2)31-28(22-8-4-5-9-23(22)29)33(27)26-14-13-21(15-25(26)30-17)34-16-20-12-11-19-7-3-6-10-24(19)32-20;1-16-25-17(2)31-23-14-20(11-12-24(23)33(25)15-30-16)35-26(21-9-4-5-10-22(21)28)18-7-6-8-19(13-18)32-27(34)29-3;1-14-24-15(2)30-25(17-6-3-4-7-19(17)26)31(24)23-11-10-16(12-22(23)29-14)32-13-18-20(27)8-5-9-21(18)28;1-15-24-16(2)28-25(20-8-3-4-9-21(20)26)29(24)23-11-10-19(13-22(23)27-15)33-14-17-6-5-7-18(12-17)30(31)32;1-15-24-16(2)29-22-13-19(10-11-23(22)30(24)14-28-15)31-25(17-6-5-7-18(27)12-17)20-8-3-4-9-21(20)26/h3-15H,16H2,1-2H3;4-15,26H,1-3H3,(H2,29,32,34);3-12H,13H2,1-2H3;3-13H,14H2,1-2H3;3-14,25H,27H2,1-2H3
InChIKeyYQNBTRDBYJKUHY-UHFFFAOYSA-N
XLogP31.91
TPSA320.28 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds22
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002288.65
LogP ≤ 531.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline?
The IUPAC name of 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline (CID 173105525) is 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline.
What is the SMILES notation for 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline?
The canonical SMILES for 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline is CNC(=O)Nc1cccc(C(Oc2ccc3c(c2)nc(C)c2c(C)ncn23)c2ccccc2Cl)c1.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3c(F)cccc3F)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3ccc4ccccc4n3)ccc12.Cc1nc(-c2ccccc2Cl)n2c1c(C)nc1cc(OCc3cccc([N+](=O)[O-])c3)ccc12.Cc1ncn2c1c(C)nc1cc(OC(c3cccc(N)c3)c3ccccc3Cl)ccc12.
What is the InChIKey of 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline?
The InChIKey is YQNBTRDBYJKUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21ClN4O.C27H24ClN5O2.C25H18ClF2N3O.C25H19ClN4O3.C25H21ClN4O/c1-17-27-18(2)31-28(22-8-4-5-9-23(22)29)33(27)26-14-13-21(15-25(26)30-17)34-16-20-12-11-19-7-3-6-10-24(19)32-20;1-16-25-17(2)31-23-14-20(11-12-24(23)33(25)15-30-16)35-26(21-9-4-5-10-22(21)28)18-7-6-8-19(13-18)32-27(34)29-3;1-14-24-15(2)30-25(17-6-3-4-7-19(17)26)31(24)23-11-10-16(12-22(23)29-14)32-13-18-20(27)8-5-9-21(18)28;1-15-24-16(2)28-25(20-8-3-4-9-21(20)26)29(24)23-11-10-19(13-22(23)27-15)33-14-17-6-5-7-18(12-17)30(31)32;1-15-24-16(2)29-22-13-19(10-11-23(22)30(24)14-28-15)31-25(17-6-5-7-18(27)12-17)20-8-3-4-9-21(20)26/h3-15H,16H2,1-2H3;4-15,26H,1-3H3,(H2,29,32,34);3-12H,13H2,1-2H3;3-13H,14H2,1-2H3;3-14,25H,27H2,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline?
1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline has a molecular weight of 2288.65 g/mol, XLogP of 31.91, 22 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-7-[(2,6-difluorophenyl)methoxy]-3,4-dimethylimidazo[1,5-a]quinoxaline;3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]aniline;1-[3-[(2-chlorophenyl)-(3,4-dimethylimidazo[1,5-a]quinoxalin-7-yl)oxymethyl]phenyl]-3-methylurea;1-(2-chlorophenyl)-3,4-dimethyl-7-[(3-nitrophenyl)methoxy]imidazo[1,5-a]quinoxaline;1-(2-chlorophenyl)-3,4-dimethyl-7-(quinolin-2-ylmethoxy)imidazo[1,5-a]quinoxaline is sourced from PubChem (CID 173105525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).