1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

C129H112Cl3F9N10O17 — CID 161303198

IUPAC1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOc1cc2c(Oc3ccc(NC(=O)Cc4ccc(Cl)c(C(F)(F)F)c4)cc3)ccnc2cc1OCC1(N)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N)CC1
InChIInChI=1S/C35H30ClF3N2O4.C33H26ClF3N2O4.C32H31N3O5.C29H25ClF3N3O4/c1-41(2)34(12-13-34)20-44-33-19-29-26(18-32(33)43-3)31(11-14-40-29)45-23-8-9-24-22(17-23)5-4-6-25(24)30(42)16-21-7-10-28(36)27(15-21)35(37,38)39;1-41-30-16-24-27(17-31(30)42-18-32(38)10-11-32)39-12-9-29(24)43-21-6-7-22-20(15-21)3-2-4-23(22)28(40)14-19-5-8-26(34)25(13-19)33(35,36)37;1-20-14-22(34-40-20)16-28(36)25-7-5-6-21-15-23(8-9-24(21)25)39-29-10-13-33-27-18-31(30(37-4)17-26(27)29)38-19-32(11-12-32)35(2)3;1-38-25-14-20-23(15-26(25)39-16-28(34)9-10-28)35-11-8-24(20)40-19-5-3-18(4-6-19)36-27(37)13-17-2-7-22(30)21(12-17)29(31,32)33/h4-11,14-15,17-19H,12-13,16,20H2,1-3H3;2-9,12-13,15-17H,10-11,14,18,38H2,1H3;5-10,13-15,17-18H,11-12,16,19H2,1-4H3;2-8,11-12,14-15H,9-10,13,16,34H2,1H3,(H,36,37)
InChIKeyVHWXMTLCVQPWSP-UHFFFAOYSA-N
MW2351.71 g/mol
LogP30.06
Rot. Bonds38

About 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (PubChem CID 161303198) has the molecular formula C129H112Cl3F9N10O17 and a molecular weight of 2351.71 g/mol. Its IUPAC name is 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.

Molecular Properties

Compound Name1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
PubChem CID161303198
Molecular FormulaC129H112Cl3F9N10O17
Molecular Weight2351.71 g/mol
Exact Mass2348.71
IUPAC Name1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOc1cc2c(Oc3ccc(NC(=O)Cc4ccc(Cl)c(C(F)(F)F)c4)cc3)ccnc2cc1OCC1(N)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N)CC1
InChIInChI=1S/C35H30ClF3N2O4.C33H26ClF3N2O4.C32H31N3O5.C29H25ClF3N3O4/c1-41(2)34(12-13-34)20-44-33-19-29-26(18-32(33)43-3)31(11-14-40-29)45-23-8-9-24-22(17-23)5-4-6-25(24)30(42)16-21-7-10-28(36)27(15-21)35(37,38)39;1-41-30-16-24-27(17-31(30)42-18-32(38)10-11-32)39-12-9-29(24)43-21-6-7-22-20(15-21)3-2-4-23(22)28(40)14-19-5-8-26(34)25(13-19)33(35,36)37;1-20-14-22(34-40-20)16-28(36)25-7-5-6-21-15-23(8-9-24(21)25)39-29-10-13-33-27-18-31(30(37-4)17-26(27)29)38-19-32(11-12-32)35(2)3;1-38-25-14-20-23(15-26(25)39-16-28(34)9-10-28)35-11-8-24(20)40-19-5-3-18(4-6-19)36-27(37)13-17-2-7-22(30)21(12-17)29(31,32)33/h4-11,14-15,17-19H,12-13,16,20H2,1-3H3;2-9,12-13,15-17H,10-11,14,18,38H2,1H3;5-10,13-15,17-18H,11-12,16,19H2,1-4H3;2-8,11-12,14-15H,9-10,13,16,34H2,1H3,(H,36,37)
InChIKeyVHWXMTLCVQPWSP-UHFFFAOYSA-N
XLogP30.06
TPSA327.18 Ų
H-Bond Donors3
H-Bond Acceptors26
Rotatable Bonds38
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002351.71
LogP ≤ 530.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1026

Analyze 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone with MolForge

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Related Compounds

2-(2,4-dichlorophenyl)-6-fluoro-N-[3-fluoro-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]oxyphenyl]quinoline-4-carboxamide
CID 71697982
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[7-[[1-[cyclopropyl(methyl)amino]cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalene-1-carboxamide
CID 25030847
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[7-[[1-[cyclopropylmethyl(methyl)amino]cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalene-1-carboxamide
CID 25030932
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalene-1-carboxamide
CID 25032011
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxynaphthalene-1-carboxamide
CID 59813214
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[7-[[1-(cyclopropylmethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalene-1-carboxamide
CID 67276484
N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-2-chlorophenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]phenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;N-[2-chloro-4-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]phenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 157637645
N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxy-2-chlorophenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxy-3-fluorophenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxy-3-fluorophenyl]-3-(5-methyl-1,2-oxazol-3-yl)-2-oxopropanamide;N-[2-chloro-4-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 157859445
6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide
CID 158101315
N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-oxopropanamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-3-(5-methyl-1,2-oxazol-3-yl)-2-oxopropanamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-2-oxobutanamide
CID 159614153
N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-oxopropanamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-3-(5-methyl-1,2-oxazol-3-yl)-2-oxopropanamide;N-[4-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-3-fluorophenyl]-2-oxobutanamide;1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-cyclopropylethanone;methane
CID 159784783
1-[6-[7-[(1-Aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
CID 160059279

Frequently Asked Questions

What is the IUPAC name of 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The IUPAC name of 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (CID 161303198) is 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.
What is the SMILES notation for 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The canonical SMILES for 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is COc1cc2c(Oc3ccc(NC(=O)Cc4ccc(Cl)c(C(F)(F)F)c4)cc3)ccnc2cc1OCC1(N)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Oc3ccc4c(C(=O)Cc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N)CC1.
What is the InChIKey of 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The InChIKey is VHWXMTLCVQPWSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H30ClF3N2O4.C33H26ClF3N2O4.C32H31N3O5.C29H25ClF3N3O4/c1-41(2)34(12-13-34)20-44-33-19-29-26(18-32(33)43-3)31(11-14-40-29)45-23-8-9-24-22(17-23)5-4-6-25(24)30(42)16-21-7-10-28(36)27(15-21)35(37,38)39;1-41-30-16-24-27(17-31(30)42-18-32(38)10-11-32)39-12-9-29(24)43-21-6-7-22-20(15-21)3-2-4-23(22)28(40)14-19-5-8-26(34)25(13-19)33(35,36)37;1-20-14-22(34-40-20)16-28(36)25-7-5-6-21-15-23(8-9-24(21)25)39-29-10-13-33-27-18-31(30(37-4)17-26(27)29)38-19-32(11-12-32)35(2)3;1-38-25-14-20-23(15-26(25)39-16-28(34)9-10-28)35-11-8-24(20)40-19-5-3-18(4-6-19)36-27(37)13-17-2-7-22(30)21(12-17)29(31,32)33/h4-11,14-15,17-19H,12-13,16,20H2,1-3H3;2-9,12-13,15-17H,10-11,14,18,38H2,1H3;5-10,13-15,17-18H,11-12,16,19H2,1-4H3;2-8,11-12,14-15H,9-10,13,16,34H2,1H3,(H,36,37).
What are the key properties of 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone has a molecular weight of 2351.71 g/mol, XLogP of 30.06, 38 rotatable bonds, 3 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-[4-chloro-3-(trifluoromethyl)phenyl]ethanone;N-[4-[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]oxyphenyl]-2-[4-chloro-3-(trifluoromethyl)phenyl]acetamide;2-[4-chloro-3-(trifluoromethyl)phenyl]-1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]ethanone;1-[6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is sourced from PubChem (CID 161303198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).