4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one

C171H171F6N15O30 — CID 159241461

IUPAC4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one
SMILESCOc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CCC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CCC2(COC2)C1
InChIInChI=1S/C30H31FN2O5.C29H30FN3O5.C29H29FN2O5.C28H28FN3O5.C28H27FN2O5.C27H26FN3O5/c1-19-12-20-5-6-25(29(31)21(20)13-19)38-24-7-9-32-23-15-27(26(35-2)14-22(23)24)37-11-3-4-28(34)33-10-8-30(16-33)17-36-18-30;1-18-10-19-5-6-23(27(30)20(19)11-18)38-28-21-12-24(35-2)25(13-22(21)31-17-32-28)37-9-3-4-26(34)33-8-7-29(14-33)15-36-16-29;1-18-10-19-5-6-24(28(30)20(19)11-18)37-23-7-8-31-22-13-26(25(34-2)12-21(22)23)36-9-3-4-27(33)32-14-29(15-32)16-35-17-29;1-17-8-18-5-6-22(26(29)19(18)9-17)37-27-20-10-23(34-2)24(11-21(20)30-16-31-27)36-7-3-4-25(33)32-12-28(13-32)14-35-15-28;1-17-9-18-3-4-23(27(29)19(18)10-17)36-22-5-7-30-21-12-25(24(33-2)11-20(21)22)35-8-6-26(32)31-13-28(14-31)15-34-16-28;1-16-7-17-3-4-21(25(28)18(17)8-16)36-26-19-9-22(33-2)23(10-20(19)29-15-30-26)35-6-5-24(32)31-11-27(12-31)13-34-14-27/h5-7,9,13-15H,3-4,8,10-12,16-18H2,1-2H3;5-6,11-13,17H,3-4,7-10,14-16H2,1-2H3;5-8,11-13H,3-4,9-10,14-17H2,1-2H3;5-6,9-11,16H,3-4,7-8,12-15H2,1-2H3;3-5,7,10-12H,6,8-9,13-16H2,1-2H3;3-4,8-10,15H,5-7,11-14H2,1-2H3
InChIKeyKUDOBFDUVCUNHX-UHFFFAOYSA-N
MW3030.31 g/mol
LogP29.10
Rot. Bonds46

About 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one

4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one (PubChem CID 159241461) has the molecular formula C171H171F6N15O30 and a molecular weight of 3030.31 g/mol. Its IUPAC name is 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one.

Molecular Properties

Compound Name4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one
PubChem CID159241461
Molecular FormulaC171H171F6N15O30
Molecular Weight3030.31 g/mol
Exact Mass3028.22
IUPAC Name4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one
SMILESCOc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CCC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CCC2(COC2)C1
InChIInChI=1S/C30H31FN2O5.C29H30FN3O5.C29H29FN2O5.C28H28FN3O5.C28H27FN2O5.C27H26FN3O5/c1-19-12-20-5-6-25(29(31)21(20)13-19)38-24-7-9-32-23-15-27(26(35-2)14-22(23)24)37-11-3-4-28(34)33-10-8-30(16-33)17-36-18-30;1-18-10-19-5-6-23(27(30)20(19)11-18)38-28-21-12-24(35-2)25(13-22(21)31-17-32-28)37-9-3-4-26(34)33-8-7-29(14-33)15-36-16-29;1-18-10-19-5-6-24(28(30)20(19)11-18)37-23-7-8-31-22-13-26(25(34-2)12-21(22)23)36-9-3-4-27(33)32-14-29(15-32)16-35-17-29;1-17-8-18-5-6-22(26(29)19(18)9-17)37-27-20-10-23(34-2)24(11-21(20)30-16-31-27)36-7-3-4-25(33)32-12-28(13-32)14-35-15-28;1-17-9-18-3-4-23(27(29)19(18)10-17)36-22-5-7-30-21-12-25(24(33-2)11-20(21)22)35-8-6-26(32)31-13-28(14-31)15-34-16-28;1-16-7-17-3-4-21(25(28)18(17)8-16)36-26-19-9-22(33-2)23(10-20(19)29-15-30-26)35-6-5-24(32)31-11-27(12-31)13-34-14-27/h5-7,9,13-15H,3-4,8,10-12,16-18H2,1-2H3;5-6,11-13,17H,3-4,7-10,14-16H2,1-2H3;5-8,11-13H,3-4,9-10,14-17H2,1-2H3;5-6,9-11,16H,3-4,7-8,12-15H2,1-2H3;3-5,7,10-12H,6,8-9,13-16H2,1-2H3;3-4,8-10,15H,5-7,11-14H2,1-2H3
InChIKeyKUDOBFDUVCUNHX-UHFFFAOYSA-N
XLogP29.10
TPSA459.39 Ų
H-Bond Donors
H-Bond Acceptors39
Rotatable Bonds46
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003030.31
LogP ≤ 529.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

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

Analyze 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one
CID 157082427
7-[3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxypropyl]-2-oxa-7-azaspiro[3.5]nonane;4-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one
CID 162211662
4-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one
CID 159265961
4-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one
CID 85469266
4-[6-methoxy-4-[(2-methyl-1H-inden-5-yl)oxy]quinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one
CID 157100110
4-[6-methoxy-4-[(2-methyl-1H-inden-5-yl)oxy]quinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)butan-1-one
CID 157082429
4-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)butan-1-one
CID 85469418
3-[6-methoxy-4-[(6-methyl-7H-cyclopenta[b]pyridin-3-yl)oxy]quinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one
CID 157100107
1-[4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxypiperidin-1-yl]propan-2-one
CID 161033051
4-[6-methoxy-4-[[3-[7-[4-[6-methoxy-4-[(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]quinazolin-7-yl]oxybutanoyl]-2-oxa-7-azaspiro[3.5]nonan-3-yl]-2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy]quinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)butan-1-one
CID 123770583
1-[2-chloro-4-[6-methoxy-7-[3-(2-oxa-7-azaspiro[3.5]nonan-7-yl)-3-oxopropoxy]quinazolin-4-yl]oxyphenyl]-4-methylpentan-2-one;1-[2-chloro-4-[6-methoxy-7-[3-(2-oxa-7-azaspiro[3.5]nonan-7-yl)-3-oxopropoxy]quinolin-4-yl]oxyphenyl]-4-methylpentan-2-one;1-[2-chloro-4-[6-methoxy-7-[3-(2-oxa-7-azaspiro[3.4]octan-7-yl)propoxy]quinazolin-4-yl]oxyphenyl]-4-methylpentan-2-one;1-[2-chloro-4-[6-methoxy-7-[3-(2-oxa-7-azaspiro[3.4]octan-7-yl)propoxy]quinolin-4-yl]oxyphenyl]-4-methylpentan-2-one
CID 160691379
1-[4-[3-[4-[(1-fluoro-7-methyl-5,6-dihydronaphthalen-2-yl)oxy]-6-methoxyquinazolin-7-yl]oxypropyl]piperazin-1-yl]ethanone
CID 142269989

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one?
The IUPAC name of 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one (CID 159241461) is 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one.
What is the SMILES notation for 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one?
The canonical SMILES for 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one is COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ccnc2cc1OCCCC(=O)N1CCC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CC2(COC2)C1.COc1cc2c(Oc3ccc4c(c3F)C=C(C)C4)ncnc2cc1OCCCC(=O)N1CCC2(COC2)C1.
What is the InChIKey of 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one?
The InChIKey is KUDOBFDUVCUNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31FN2O5.C29H30FN3O5.C29H29FN2O5.C28H28FN3O5.C28H27FN2O5.C27H26FN3O5/c1-19-12-20-5-6-25(29(31)21(20)13-19)38-24-7-9-32-23-15-27(26(35-2)14-22(23)24)37-11-3-4-28(34)33-10-8-30(16-33)17-36-18-30;1-18-10-19-5-6-23(27(30)20(19)11-18)38-28-21-12-24(35-2)25(13-22(21)31-17-32-28)37-9-3-4-26(34)33-8-7-29(14-33)15-36-16-29;1-18-10-19-5-6-24(28(30)20(19)11-18)37-23-7-8-31-22-13-26(25(34-2)12-21(22)23)36-9-3-4-27(33)32-14-29(15-32)16-35-17-29;1-17-8-18-5-6-22(26(29)19(18)9-17)37-27-20-10-23(34-2)24(11-21(20)30-16-31-27)36-7-3-4-25(33)32-12-28(13-32)14-35-15-28;1-17-9-18-3-4-23(27(29)19(18)10-17)36-22-5-7-30-21-12-25(24(33-2)11-20(21)22)35-8-6-26(32)31-13-28(14-31)15-34-16-28;1-16-7-17-3-4-21(25(28)18(17)8-16)36-26-19-9-22(33-2)23(10-20(19)29-15-30-26)35-6-5-24(32)31-11-27(12-31)13-34-14-27/h5-7,9,13-15H,3-4,8,10-12,16-18H2,1-2H3;5-6,11-13,17H,3-4,7-10,14-16H2,1-2H3;5-8,11-13H,3-4,9-10,14-17H2,1-2H3;5-6,9-11,16H,3-4,7-8,12-15H2,1-2H3;3-5,7,10-12H,6,8-9,13-16H2,1-2H3;3-4,8-10,15H,5-7,11-14H2,1-2H3.
What are the key properties of 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one?
4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one has a molecular weight of 3030.31 g/mol, XLogP of 29.10, 46 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinazolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butan-1-one;3-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-6-azaspiro[3.3]heptan-6-yl)propan-1-one;4-[4-[(4-fluoro-2-methyl-1H-inden-5-yl)oxy]-6-methoxyquinolin-7-yl]oxy-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)butan-1-one is sourced from PubChem (CID 159241461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).