1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea

C237H259ClFN39O37 — CID 158078196

IUPAC1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea
SMILESCOc1cc(Oc2ncnc3cc(OC)c(OC)cc23)ccc1NC(=O)NCCCN1CCN(C)CC1.COc1cc2nccc(Oc3cc(C)c(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3F)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3)c2cc1OC
InChIInChI=1S/2C32H36N4O4.C30H31FN4O4.C30H31N5O6.C29H30ClN5O4.C29H30N6O6.C29H31N5O4.C26H34N6O5/c1-21-17-29(40-28-10-13-33-27-19-31(39-4)30(38-3)18-25(27)28)22(2)16-26(21)35-32(37)34-24-11-14-36(15-12-24)20-23-8-6-5-7-9-23;1-21-22(2)28(40-29-12-15-33-27-19-31(39-4)30(38-3)18-25(27)29)11-10-26(21)35-32(37)34-24-13-16-36(17-14-24)20-23-8-6-5-7-9-23;1-37-28-17-23-25(18-29(28)38-2)32-13-10-26(23)39-27-9-8-22(16-24(27)31)34-30(36)33-21-11-14-35(15-12-21)19-20-6-4-3-5-7-20;1-39-28-17-23-25(18-29(28)40-2)31-13-10-27(23)41-22-8-9-24(26(16-22)35(37)38)33-30(36)32-21-11-14-34(15-12-21)19-20-6-4-3-5-7-20;1-37-26-15-22-25(16-27(26)38-2)31-18-32-28(22)39-21-8-9-24(23(30)14-21)34-29(36)33-20-10-12-35(13-11-20)17-19-6-4-3-5-7-19;1-39-26-15-22-24(16-27(26)40-2)30-18-31-28(22)41-21-8-9-23(25(14-21)35(37)38)33-29(36)32-20-10-12-34(13-11-20)17-19-6-4-3-5-7-19;1-36-26-16-24-25(17-27(26)37-2)30-19-31-28(24)38-23-10-8-21(9-11-23)32-29(35)33-22-12-14-34(15-13-22)18-20-6-4-3-5-7-20;1-31-10-12-32(13-11-31)9-5-8-27-26(33)30-20-7-6-18(14-22(20)34-2)37-25-19-15-23(35-3)24(36-4)16-21(19)28-17-29-25/h5-10,13,16-19,24H,11-12,14-15,20H2,1-4H3,(H2,34,35,37);5-12,15,18-19,24H,13-14,16-17,20H2,1-4H3,(H2,34,35,37);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,33,34,36);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,32,33,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,33,34,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,32,33,36);3-11,16-17,19,22H,12-15,18H2,1-2H3,(H2,32,33,35);6-7,14-17H,5,8-13H2,1-4H3,(H2,27,30,33)
InChIKeyFMPXLYAXCJWYGO-UHFFFAOYSA-N
MW4300.37 g/mol
LogP44.05
Rot. Bonds68

About 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea

1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea (PubChem CID 158078196) has the molecular formula C237H259ClFN39O37 and a molecular weight of 4300.37 g/mol. Its IUPAC name is 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea.

Molecular Properties

Compound Name1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea
PubChem CID158078196
Molecular FormulaC237H259ClFN39O37
Molecular Weight4300.37 g/mol
Exact Mass4296.93
IUPAC Name1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea
SMILESCOc1cc(Oc2ncnc3cc(OC)c(OC)cc23)ccc1NC(=O)NCCCN1CCN(C)CC1.COc1cc2nccc(Oc3cc(C)c(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3F)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3)c2cc1OC
InChIInChI=1S/2C32H36N4O4.C30H31FN4O4.C30H31N5O6.C29H30ClN5O4.C29H30N6O6.C29H31N5O4.C26H34N6O5/c1-21-17-29(40-28-10-13-33-27-19-31(39-4)30(38-3)18-25(27)28)22(2)16-26(21)35-32(37)34-24-11-14-36(15-12-24)20-23-8-6-5-7-9-23;1-21-22(2)28(40-29-12-15-33-27-19-31(39-4)30(38-3)18-25(27)29)11-10-26(21)35-32(37)34-24-13-16-36(17-14-24)20-23-8-6-5-7-9-23;1-37-28-17-23-25(18-29(28)38-2)32-13-10-26(23)39-27-9-8-22(16-24(27)31)34-30(36)33-21-11-14-35(15-12-21)19-20-6-4-3-5-7-20;1-39-28-17-23-25(18-29(28)40-2)31-13-10-27(23)41-22-8-9-24(26(16-22)35(37)38)33-30(36)32-21-11-14-34(15-12-21)19-20-6-4-3-5-7-20;1-37-26-15-22-25(16-27(26)38-2)31-18-32-28(22)39-21-8-9-24(23(30)14-21)34-29(36)33-20-10-12-35(13-11-20)17-19-6-4-3-5-7-19;1-39-26-15-22-24(16-27(26)40-2)30-18-31-28(22)41-21-8-9-23(25(14-21)35(37)38)33-29(36)32-20-10-12-34(13-11-20)17-19-6-4-3-5-7-19;1-36-26-16-24-25(17-27(26)37-2)30-19-31-28(24)38-23-10-8-21(9-11-23)32-29(35)33-22-12-14-34(15-13-22)18-20-6-4-3-5-7-20;1-31-10-12-32(13-11-31)9-5-8-27-26(33)30-20-7-6-18(14-22(20)34-2)37-25-19-15-23(35-3)24(36-4)16-21(19)28-17-29-25/h5-10,13,16-19,24H,11-12,14-15,20H2,1-4H3,(H2,34,35,37);5-12,15,18-19,24H,13-14,16-17,20H2,1-4H3,(H2,34,35,37);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,33,34,36);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,32,33,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,33,34,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,32,33,36);3-11,16-17,19,22H,12-15,18H2,1-2H3,(H2,32,33,35);6-7,14-17H,5,8-13H2,1-4H3,(H2,27,30,33)
InChIKeyFMPXLYAXCJWYGO-UHFFFAOYSA-N
XLogP44.05
TPSA829.91 Ų
H-Bond Donors16
H-Bond Acceptors58
Rotatable Bonds68
Heavy Atoms315
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004300.37
LogP ≤ 544.05
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1058

Analyze 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea with MolForge

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Related Compounds

1-[2-Chloro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinazolin-10-yl]oxy]phenyl]-3-[1-(4-fluorophenyl)ethyl]urea
CID 146438511
1-[2-chloro-4-[[5-[3-(4-methylpiperazin-1-yl)propoxy]-2,3-dihydro-[1,4]dioxino[2,3-f]quinazolin-10-yl]oxy]phenyl]-3-[(1R)-1-(4-fluorophenyl)ethyl]urea
CID 146438650
1-[2-chloro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinazolin-10-yl]oxy]phenyl]-3-[(1R)-1-(4-fluorophenyl)ethyl]urea
CID 146438760
3-(2-chlorophenoxy)propyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;3-(2-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;3-(2-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;3-(2-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;[4-(trifluoromethyl)phenyl]methyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;[4-(trifluoromethyl)phenyl]methyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;[4-(trifluoromethyl)phenyl]methyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;[4-(trifluoromethyl)phenyl]methyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate
CID 158236357
CID 160063837
CID 160063837
CID 160407351
CID 160407351
3-(4-chlorophenoxy)propyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;3-(4-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate;3-(4-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamate;3-(4-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate;3-(2-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate;3-(4-chlorophenoxy)propyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate;1-(4-methoxyphenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate;[4-(trifluoromethyl)phenyl]methyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate
CID 160523159
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
1-[2-Chloro-4-[(5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl)oxy]phenyl]-3-ethylurea;1-[2-chloro-4-[(5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl)oxy]phenyl]-3-methylurea;1-[2-chloro-4-[(5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl)oxy]phenyl]-3-propylurea;1-(2-fluoro-4-methylphenyl)-3-[4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]phenyl]urea;1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]phenyl]urea;1-(4-methylphenyl)-3-[4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]phenyl]urea
CID 161157520
CID 157111119
CID 157111119
1-[2-(Diethylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-(2-morpholin-4-ylethyl)urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-(2-pyrrolidin-1-ylethyl)urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-[2-(dimethylamino)ethyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(2-morpholin-4-ylethyl)urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]-3-[2-(dimethylamino)ethyl]urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]-3-[2-(dimethylamino)ethyl]urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-(2-morpholin-4-ylethyl)urea
CID 157519435
1-[2-Chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea;1-[2-chloro-4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-[2-(diethylamino)ethyl]urea;1-[3-chloro-4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-[2-(diethylamino)ethyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-3-(2-morpholin-4-ylethyl)urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-3-(2-pyrrolidin-1-ylethyl)urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea;1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-[2-[di(propan-2-yl)amino]ethyl]urea
CID 157575863

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea?
The IUPAC name of 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea (CID 158078196) is 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea.
What is the SMILES notation for 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea?
The canonical SMILES for 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea is COc1cc(Oc2ncnc3cc(OC)c(OC)cc23)ccc1NC(=O)NCCCN1CCN(C)CC1.COc1cc2nccc(Oc3cc(C)c(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(C)c3C)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3F)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c(Cl)c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)c([N+](=O)[O-])c3)c2cc1OC.COc1cc2ncnc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3)c2cc1OC.
What is the InChIKey of 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea?
The InChIKey is FMPXLYAXCJWYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C32H36N4O4.C30H31FN4O4.C30H31N5O6.C29H30ClN5O4.C29H30N6O6.C29H31N5O4.C26H34N6O5/c1-21-17-29(40-28-10-13-33-27-19-31(39-4)30(38-3)18-25(27)28)22(2)16-26(21)35-32(37)34-24-11-14-36(15-12-24)20-23-8-6-5-7-9-23;1-21-22(2)28(40-29-12-15-33-27-19-31(39-4)30(38-3)18-25(27)29)11-10-26(21)35-32(37)34-24-13-16-36(17-14-24)20-23-8-6-5-7-9-23;1-37-28-17-23-25(18-29(28)38-2)32-13-10-26(23)39-27-9-8-22(16-24(27)31)34-30(36)33-21-11-14-35(15-12-21)19-20-6-4-3-5-7-20;1-39-28-17-23-25(18-29(28)40-2)31-13-10-27(23)41-22-8-9-24(26(16-22)35(37)38)33-30(36)32-21-11-14-34(15-12-21)19-20-6-4-3-5-7-20;1-37-26-15-22-25(16-27(26)38-2)31-18-32-28(22)39-21-8-9-24(23(30)14-21)34-29(36)33-20-10-12-35(13-11-20)17-19-6-4-3-5-7-19;1-39-26-15-22-24(16-27(26)40-2)30-18-31-28(22)41-21-8-9-23(25(14-21)35(37)38)33-29(36)32-20-10-12-34(13-11-20)17-19-6-4-3-5-7-19;1-36-26-16-24-25(17-27(26)37-2)30-19-31-28(24)38-23-10-8-21(9-11-23)32-29(35)33-22-12-14-34(15-13-22)18-20-6-4-3-5-7-20;1-31-10-12-32(13-11-31)9-5-8-27-26(33)30-20-7-6-18(14-22(20)34-2)37-25-19-15-23(35-3)24(36-4)16-21(19)28-17-29-25/h5-10,13,16-19,24H,11-12,14-15,20H2,1-4H3,(H2,34,35,37);5-12,15,18-19,24H,13-14,16-17,20H2,1-4H3,(H2,34,35,37);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,33,34,36);3-10,13,16-18,21H,11-12,14-15,19H2,1-2H3,(H2,32,33,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,33,34,36);3-9,14-16,18,20H,10-13,17H2,1-2H3,(H2,32,33,36);3-11,16-17,19,22H,12-15,18H2,1-2H3,(H2,32,33,35);6-7,14-17H,5,8-13H2,1-4H3,(H2,27,30,33).
What are the key properties of 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea?
1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea has a molecular weight of 4300.37 g/mol, XLogP of 44.05, 68 rotatable bonds, 16 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzylpiperidin-4-yl)-3-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]urea;1-(1-benzylpiperidin-4-yl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitrophenyl]urea;1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-methoxyphenyl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea is sourced from PubChem (CID 158078196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).