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

C159H157Cl3F5N21O33 — CID 161157520

IUPAC1-[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
SMILESCCCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)c(F)c1.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)cc1.O=C(Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)cc1)Nc1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C32H30F4N4O6.C32H33FN4O6.C32H34N4O6.C22H22ClN3O5.C21H20ClN3O5.C20H18ClN3O5/c33-23-7-2-20(32(34,35)36)18-24(23)39-31(41)38-21-3-5-22(6-4-21)46-26-8-9-37-25-19-27(29-30(28(25)26)45-17-16-44-29)43-13-1-10-40-11-14-42-15-12-40;1-21-3-8-25(24(33)19-21)36-32(38)35-22-4-6-23(7-5-22)43-27-9-10-34-26-20-28(30-31(29(26)27)42-18-17-41-30)40-14-2-11-37-12-15-39-16-13-37;1-22-3-5-23(6-4-22)34-32(37)35-24-7-9-25(10-8-24)42-27-11-12-33-26-21-28(30-31(29(26)27)41-20-19-40-30)39-16-2-13-36-14-17-38-18-15-36;1-3-7-25-22(27)26-15-5-4-13(11-14(15)23)31-17-6-8-24-16-12-18(28-2)20-21(19(16)17)30-10-9-29-20;1-3-23-21(26)25-14-5-4-12(10-13(14)22)30-16-6-7-24-15-11-17(27-2)19-20(18(15)16)29-9-8-28-19;1-22-20(25)24-13-4-3-11(9-12(13)21)29-15-5-6-23-14-10-16(26-2)18-19(17(14)15)28-8-7-27-18/h2-9,18-19H,1,10-17H2,(H2,38,39,41);3-10,19-20H,2,11-18H2,1H3,(H2,35,36,38);3-12,21H,2,13-20H2,1H3,(H2,34,35,37);4-6,8,11-12H,3,7,9-10H2,1-2H3,(H2,25,26,27);4-7,10-11H,3,8-9H2,1-2H3,(H2,23,25,26);3-6,9-10H,7-8H2,1-2H3,(H2,22,24,25)
InChIKeyUPMJYRPIHGTSCI-UHFFFAOYSA-N
MW3091.47 g/mol
LogP32.35
Rot. Bonds42

About 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

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 (PubChem CID 161157520) has the molecular formula C159H157Cl3F5N21O33 and a molecular weight of 3091.47 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name1-[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
PubChem CID161157520
Molecular FormulaC159H157Cl3F5N21O33
Molecular Weight3091.47 g/mol
Exact Mass3088.02
IUPAC Name1-[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
SMILESCCCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)c(F)c1.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)cc1.O=C(Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)cc1)Nc1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C32H30F4N4O6.C32H33FN4O6.C32H34N4O6.C22H22ClN3O5.C21H20ClN3O5.C20H18ClN3O5/c33-23-7-2-20(32(34,35)36)18-24(23)39-31(41)38-21-3-5-22(6-4-21)46-26-8-9-37-25-19-27(29-30(28(25)26)45-17-16-44-29)43-13-1-10-40-11-14-42-15-12-40;1-21-3-8-25(24(33)19-21)36-32(38)35-22-4-6-23(7-5-22)43-27-9-10-34-26-20-28(30-31(29(26)27)42-18-17-41-30)40-14-2-11-37-12-15-39-16-13-37;1-22-3-5-23(6-4-22)34-32(37)35-24-7-9-25(10-8-24)42-27-11-12-33-26-21-28(30-31(29(26)27)41-20-19-40-30)39-16-2-13-36-14-17-38-18-15-36;1-3-7-25-22(27)26-15-5-4-13(11-14(15)23)31-17-6-8-24-16-12-18(28-2)20-21(19(16)17)30-10-9-29-20;1-3-23-21(26)25-14-5-4-12(10-13(14)22)30-16-6-7-24-15-11-17(27-2)19-20(18(15)16)29-9-8-28-19;1-22-20(25)24-13-4-3-11(9-12(13)21)29-15-5-6-23-14-10-16(26-2)18-19(17(14)15)28-8-7-27-18/h2-9,18-19H,1,10-17H2,(H2,38,39,41);3-10,19-20H,2,11-18H2,1H3,(H2,35,36,38);3-12,21H,2,13-20H2,1H3,(H2,34,35,37);4-6,8,11-12H,3,7,9-10H2,1-2H3,(H2,25,26,27);4-7,10-11H,3,8-9H2,1-2H3,(H2,23,25,26);3-6,9-10H,7-8H2,1-2H3,(H2,22,24,25)
InChIKeyUPMJYRPIHGTSCI-UHFFFAOYSA-N
XLogP32.35
TPSA583.05 Ų
H-Bond Donors12
H-Bond Acceptors42
Rotatable Bonds42
Heavy Atoms221
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003091.47
LogP ≤ 532.35
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

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

Analyze 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 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

N-(2-chlorophenyl)-7-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dihydro-1,4-benzoxazine-4-carboxamide
CID 24824318
1-[2-Chloro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinazolin-10-yl]oxy]phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
CID 146403716
US11479559, Example 42
CID 139405590
US10980809, Example 91
CID 139405612
US11479559, Example 22
CID 139405628
US11479559, Example 21
CID 139405629
US11479559, Example 33
CID 139405643
US11479559, Example 27
CID 139405646
US11479559, Example 77
CID 139405669
US11479559, Example 78
CID 139405670
US10980809, Example 92
CID 139405719
US11479559, Example 13
CID 139405741

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.CNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c4c(c23)OCCO4)cc1Cl.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)c(F)c1.Cc1ccc(NC(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c5c(c34)OCCO5)cc2)cc1.O=C(Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)cc1)Nc1cc(C(F)(F)F)ccc1F.
What is the InChIKey of 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?
The InChIKey is UPMJYRPIHGTSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30F4N4O6.C32H33FN4O6.C32H34N4O6.C22H22ClN3O5.C21H20ClN3O5.C20H18ClN3O5/c33-23-7-2-20(32(34,35)36)18-24(23)39-31(41)38-21-3-5-22(6-4-21)46-26-8-9-37-25-19-27(29-30(28(25)26)45-17-16-44-29)43-13-1-10-40-11-14-42-15-12-40;1-21-3-8-25(24(33)19-21)36-32(38)35-22-4-6-23(7-5-22)43-27-9-10-34-26-20-28(30-31(29(26)27)42-18-17-41-30)40-14-2-11-37-12-15-39-16-13-37;1-22-3-5-23(6-4-22)34-32(37)35-24-7-9-25(10-8-24)42-27-11-12-33-26-21-28(30-31(29(26)27)41-20-19-40-30)39-16-2-13-36-14-17-38-18-15-36;1-3-7-25-22(27)26-15-5-4-13(11-14(15)23)31-17-6-8-24-16-12-18(28-2)20-21(19(16)17)30-10-9-29-20;1-3-23-21(26)25-14-5-4-12(10-13(14)22)30-16-6-7-24-15-11-17(27-2)19-20(18(15)16)29-9-8-28-19;1-22-20(25)24-13-4-3-11(9-12(13)21)29-15-5-6-23-14-10-16(26-2)18-19(17(14)15)28-8-7-27-18/h2-9,18-19H,1,10-17H2,(H2,38,39,41);3-10,19-20H,2,11-18H2,1H3,(H2,35,36,38);3-12,21H,2,13-20H2,1H3,(H2,34,35,37);4-6,8,11-12H,3,7,9-10H2,1-2H3,(H2,25,26,27);4-7,10-11H,3,8-9H2,1-2H3,(H2,23,25,26);3-6,9-10H,7-8H2,1-2H3,(H2,22,24,25).
What are the key properties of 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?
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 has a molecular weight of 3091.47 g/mol, XLogP of 32.35, 42 rotatable bonds, 12 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 161157520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).