1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate

C213H180Cl2F24N20O40 — CID 160742173

IUPAC1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate
SMILESCOc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3C)c2cc1OC.COc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3)c2cc1OC
InChIInChI=1S/C29H27F3N2O5.2C28H25F3N2O5.C26H21ClF3N3O5.C26H22F3N3O5.C26H21F3N2O5.C25H19ClF3N3O5.C25H20F3N3O5/c1-16-12-25(39-24-9-10-33-23-15-27(37-5)26(36-4)14-21(23)24)17(2)11-22(16)34-28(35)38-18(3)19-7-6-8-20(13-19)29(30,31)32;1-14-9-25(38-24-6-7-32-23-13-27(36-5)26(35-4)11-18(23)24)15(2)8-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14-15(2)24(38-25-8-9-32-23-13-27(36-5)26(35-4)11-18(23)25)7-6-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14(15-5-4-6-16(9-15)26(28,29)30)37-25(34)33-20-8-7-17(10-19(20)27)38-24-18-11-22(35-2)23(36-3)12-21(18)31-13-32-24;1-15(16-5-4-6-17(11-16)26(27,28)29)36-25(33)32-18-7-9-19(10-8-18)37-24-20-12-22(34-2)23(35-3)13-21(20)30-14-31-24;1-14(17-10-20(28)21(29)12-19(17)27)35-26(32)31-15-4-6-16(7-5-15)36-23-8-9-30-22-13-25(34-3)24(33-2)11-18(22)23;1-12(14-7-18(28)19(29)9-17(14)27)36-25(33)32-20-5-4-13(6-16(20)26)37-24-15-8-22(34-2)23(35-3)10-21(15)30-11-31-24;1-13(16-8-19(27)20(28)10-18(16)26)35-25(32)31-14-4-6-15(7-5-14)36-24-17-9-22(33-2)23(34-3)11-21(17)29-12-30-24/h6-15,18H,1-5H3,(H,34,35);2*6-13,16H,1-5H3,(H,33,34);4-14H,1-3H3,(H,33,34);4-15H,1-3H3,(H,32,33);4-14H,1-3H3,(H,31,32);4-12H,1-3H3,(H,32,33);4-13H,1-3H3,(H,31,32)
InChIKeyRVSNKMZEDSJROM-UHFFFAOYSA-N
MW4186.74 g/mol
LogP56.71
Rot. Bonds56

About 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate

1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate (PubChem CID 160742173) has the molecular formula C213H180Cl2F24N20O40 and a molecular weight of 4186.74 g/mol. Its IUPAC name is 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate.

Molecular Properties

Compound Name1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate
PubChem CID160742173
Molecular FormulaC213H180Cl2F24N20O40
Molecular Weight4186.74 g/mol
Exact Mass4183.17
IUPAC Name1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate
SMILESCOc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3C)c2cc1OC.COc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3)c2cc1OC
InChIInChI=1S/C29H27F3N2O5.2C28H25F3N2O5.C26H21ClF3N3O5.C26H22F3N3O5.C26H21F3N2O5.C25H19ClF3N3O5.C25H20F3N3O5/c1-16-12-25(39-24-9-10-33-23-15-27(37-5)26(36-4)14-21(23)24)17(2)11-22(16)34-28(35)38-18(3)19-7-6-8-20(13-19)29(30,31)32;1-14-9-25(38-24-6-7-32-23-13-27(36-5)26(35-4)11-18(23)24)15(2)8-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14-15(2)24(38-25-8-9-32-23-13-27(36-5)26(35-4)11-18(23)25)7-6-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14(15-5-4-6-16(9-15)26(28,29)30)37-25(34)33-20-8-7-17(10-19(20)27)38-24-18-11-22(35-2)23(36-3)12-21(18)31-13-32-24;1-15(16-5-4-6-17(11-16)26(27,28)29)36-25(33)32-18-7-9-19(10-8-18)37-24-20-12-22(34-2)23(35-3)13-21(20)30-14-31-24;1-14(17-10-20(28)21(29)12-19(17)27)35-26(32)31-15-4-6-16(7-5-15)36-23-8-9-30-22-13-25(34-3)24(33-2)11-18(22)23;1-12(14-7-18(28)19(29)9-17(14)27)36-25(33)32-20-5-4-13(6-16(20)26)37-24-15-8-22(34-2)23(35-3)10-21(15)30-11-31-24;1-13(16-8-19(27)20(28)10-18(16)26)35-25(32)31-14-4-6-15(7-5-14)36-24-17-9-22(33-2)23(34-3)11-21(17)29-12-30-24/h6-15,18H,1-5H3,(H,34,35);2*6-13,16H,1-5H3,(H,33,34);4-14H,1-3H3,(H,33,34);4-15H,1-3H3,(H,32,33);4-14H,1-3H3,(H,31,32);4-12H,1-3H3,(H,32,33);4-13H,1-3H3,(H,31,32)
InChIKeyRVSNKMZEDSJROM-UHFFFAOYSA-N
XLogP56.71
TPSA682.84 Ų
H-Bond Donors8
H-Bond Acceptors52
Rotatable Bonds56
Heavy Atoms299
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004186.74
LogP ≤ 556.71
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1052

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate?
The IUPAC name of 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate (CID 160742173) is 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate.
What is the SMILES notation for 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate?
The canonical SMILES for 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate is COc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3C)c2cc1OC.COc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cc(F)c(F)cc4F)cc3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)OC(C)c4cccc(C(F)(F)F)c4)cc3)c2cc1OC.
What is the InChIKey of 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate?
The InChIKey is RVSNKMZEDSJROM-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27F3N2O5.2C28H25F3N2O5.C26H21ClF3N3O5.C26H22F3N3O5.C26H21F3N2O5.C25H19ClF3N3O5.C25H20F3N3O5/c1-16-12-25(39-24-9-10-33-23-15-27(37-5)26(36-4)14-21(23)24)17(2)11-22(16)34-28(35)38-18(3)19-7-6-8-20(13-19)29(30,31)32;1-14-9-25(38-24-6-7-32-23-13-27(36-5)26(35-4)11-18(23)24)15(2)8-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14-15(2)24(38-25-8-9-32-23-13-27(36-5)26(35-4)11-18(23)25)7-6-22(14)33-28(34)37-16(3)17-10-20(30)21(31)12-19(17)29;1-14(15-5-4-6-16(9-15)26(28,29)30)37-25(34)33-20-8-7-17(10-19(20)27)38-24-18-11-22(35-2)23(36-3)12-21(18)31-13-32-24;1-15(16-5-4-6-17(11-16)26(27,28)29)36-25(33)32-18-7-9-19(10-8-18)37-24-20-12-22(34-2)23(35-3)13-21(20)30-14-31-24;1-14(17-10-20(28)21(29)12-19(17)27)35-26(32)31-15-4-6-16(7-5-15)36-23-8-9-30-22-13-25(34-3)24(33-2)11-18(22)23;1-12(14-7-18(28)19(29)9-17(14)27)36-25(33)32-20-5-4-13(6-16(20)26)37-24-15-8-22(34-2)23(35-3)10-21(15)30-11-31-24;1-13(16-8-19(27)20(28)10-18(16)26)35-25(32)31-14-4-6-15(7-5-14)36-24-17-9-22(33-2)23(34-3)11-21(17)29-12-30-24/h6-15,18H,1-5H3,(H,34,35);2*6-13,16H,1-5H3,(H,33,34);4-14H,1-3H3,(H,33,34);4-15H,1-3H3,(H,32,33);4-14H,1-3H3,(H,31,32);4-12H,1-3H3,(H,32,33);4-13H,1-3H3,(H,31,32).
What are the key properties of 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate?
1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate has a molecular weight of 4186.74 g/mol, XLogP of 56.71, 56 rotatable bonds, 8 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(trifluoromethyl)phenyl]ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-[3-(trifluoromethyl)phenyl]ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;1-(2,4,5-trifluorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate is sourced from PubChem (CID 160742173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).