4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea

C177H190ClF21N28O26 — CID 158001971

IUPAC4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea
SMILESCCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)ccn1.CCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(OC(F)(F)F)cc3)cc2)ccn1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(C(F)(F)F)cc3)CC2)cc1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)cc1.N#Cc1ccc(NC(=O)NC2CCC(Oc3ccc(C#N)cc3)CC2)cc1.O=C(Nc1ccc(OC(F)(F)F)cc1)NC1CCC(Oc2ccnc(C(=O)N3CCCC3)c2)CC1
InChIInChI=1S/C24H28ClF3N4O3.C24H27F3N4O4.C24H29F3N4O4.C21H23F3N4O4.C21H17F3N4O4.C21H23F3N2O3.C21H23F3N2O2.C21H20N4O2/c1-3-32(4-2)22(33)21-14-18(11-12-29-21)35-17-8-5-15(6-9-17)30-23(34)31-16-7-10-20(25)19(13-16)24(26,27)28;25-24(26,27)35-19-9-5-17(6-10-19)30-23(33)29-16-3-7-18(8-4-16)34-20-11-12-28-21(15-20)22(32)31-13-1-2-14-31;1-3-31(4-2)22(32)21-15-20(13-14-28-21)34-18-9-5-16(6-10-18)29-23(33)30-17-7-11-19(12-8-17)35-24(25,26)27;2*1-25-19(29)18-12-17(10-11-26-18)31-15-6-2-13(3-7-15)27-20(30)28-14-4-8-16(9-5-14)32-21(22,23)24;1-14-2-8-17(9-3-14)28-18-10-4-15(5-11-18)25-20(27)26-16-6-12-19(13-7-16)29-21(22,23)24;1-14-2-10-18(11-3-14)28-19-12-8-17(9-13-19)26-20(27)25-16-6-4-15(5-7-16)21(22,23)24;22-13-15-1-5-17(6-2-15)24-21(26)25-18-7-11-20(12-8-18)27-19-9-3-16(14-23)4-10-19/h7,10-15,17H,3-6,8-9H2,1-2H3,(H2,30,31,34);5-6,9-12,15-16,18H,1-4,7-8,13-14H2,(H2,29,30,33);7-8,11-16,18H,3-6,9-10H2,1-2H3,(H2,29,30,33);4-5,8-13,15H,2-3,6-7H2,1H3,(H,25,29)(H2,27,28,30);2-12H,1H3,(H,25,29)(H2,27,28,30);2-3,6-9,12-13,15,18H,4-5,10-11H2,1H3,(H2,25,26,27);2-7,10-11,17,19H,8-9,12-13H2,1H3,(H2,25,26,27);1-6,9-10,18,20H,7-8,11-12H2,(H2,24,25,26)
InChIKeyFDVNEORXBGVSSS-UHFFFAOYSA-N
MW3560.05 g/mol
LogP38.95
Rot. Bonds46

About 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea

4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea (PubChem CID 158001971) has the molecular formula C177H190ClF21N28O26 and a molecular weight of 3560.05 g/mol. Its IUPAC name is 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea.

Molecular Properties

Compound Name4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea
PubChem CID158001971
Molecular FormulaC177H190ClF21N28O26
Molecular Weight3560.05 g/mol
Exact Mass3557.38
IUPAC Name4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea
SMILESCCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)ccn1.CCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(OC(F)(F)F)cc3)cc2)ccn1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(C(F)(F)F)cc3)CC2)cc1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)cc1.N#Cc1ccc(NC(=O)NC2CCC(Oc3ccc(C#N)cc3)CC2)cc1.O=C(Nc1ccc(OC(F)(F)F)cc1)NC1CCC(Oc2ccnc(C(=O)N3CCCC3)c2)CC1
InChIInChI=1S/C24H28ClF3N4O3.C24H27F3N4O4.C24H29F3N4O4.C21H23F3N4O4.C21H17F3N4O4.C21H23F3N2O3.C21H23F3N2O2.C21H20N4O2/c1-3-32(4-2)22(33)21-14-18(11-12-29-21)35-17-8-5-15(6-9-17)30-23(34)31-16-7-10-20(25)19(13-16)24(26,27)28;25-24(26,27)35-19-9-5-17(6-10-19)30-23(33)29-16-3-7-18(8-4-16)34-20-11-12-28-21(15-20)22(32)31-13-1-2-14-31;1-3-31(4-2)22(32)21-15-20(13-14-28-21)34-18-9-5-16(6-10-18)29-23(33)30-17-7-11-19(12-8-17)35-24(25,26)27;2*1-25-19(29)18-12-17(10-11-26-18)31-15-6-2-13(3-7-15)27-20(30)28-14-4-8-16(9-5-14)32-21(22,23)24;1-14-2-8-17(9-3-14)28-18-10-4-15(5-11-18)25-20(27)26-16-6-12-19(13-7-16)29-21(22,23)24;1-14-2-10-18(11-3-14)28-19-12-8-17(9-13-19)26-20(27)25-16-6-4-15(5-7-16)21(22,23)24;22-13-15-1-5-17(6-2-15)24-21(26)25-18-7-11-20(12-8-18)27-19-9-3-16(14-23)4-10-19/h7,10-15,17H,3-6,8-9H2,1-2H3,(H2,30,31,34);5-6,9-12,15-16,18H,1-4,7-8,13-14H2,(H2,29,30,33);7-8,11-16,18H,3-6,9-10H2,1-2H3,(H2,29,30,33);4-5,8-13,15H,2-3,6-7H2,1H3,(H,25,29)(H2,27,28,30);2-12H,1H3,(H,25,29)(H2,27,28,30);2-3,6-9,12-13,15,18H,4-5,10-11H2,1H3,(H2,25,26,27);2-7,10-11,17,19H,8-9,12-13H2,1H3,(H2,25,26,27);1-6,9-10,18,20H,7-8,11-12H2,(H2,24,25,26)
InChIKeyFDVNEORXBGVSSS-UHFFFAOYSA-N
XLogP38.95
TPSA680.19 Ų
H-Bond Donors18
H-Bond Acceptors33
Rotatable Bonds46
Heavy Atoms253
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003560.05
LogP ≤ 538.95
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1033

Analyze 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea?
The IUPAC name of 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea (CID 158001971) is 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea.
What is the SMILES notation for 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea?
The canonical SMILES for 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea is CCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)ccn1.CCN(CC)C(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(OC(F)(F)F)cc3)cc2)ccn1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(C(F)(F)F)cc3)CC2)cc1.Cc1ccc(OC2CCC(NC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)cc1.N#Cc1ccc(NC(=O)NC2CCC(Oc3ccc(C#N)cc3)CC2)cc1.O=C(Nc1ccc(OC(F)(F)F)cc1)NC1CCC(Oc2ccnc(C(=O)N3CCCC3)c2)CC1.
What is the InChIKey of 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea?
The InChIKey is FDVNEORXBGVSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28ClF3N4O3.C24H27F3N4O4.C24H29F3N4O4.C21H23F3N4O4.C21H17F3N4O4.C21H23F3N2O3.C21H23F3N2O2.C21H20N4O2/c1-3-32(4-2)22(33)21-14-18(11-12-29-21)35-17-8-5-15(6-9-17)30-23(34)31-16-7-10-20(25)19(13-16)24(26,27)28;25-24(26,27)35-19-9-5-17(6-10-19)30-23(33)29-16-3-7-18(8-4-16)34-20-11-12-28-21(15-20)22(32)31-13-1-2-14-31;1-3-31(4-2)22(32)21-15-20(13-14-28-21)34-18-9-5-16(6-10-18)29-23(33)30-17-7-11-19(12-8-17)35-24(25,26)27;2*1-25-19(29)18-12-17(10-11-26-18)31-15-6-2-13(3-7-15)27-20(30)28-14-4-8-16(9-5-14)32-21(22,23)24;1-14-2-8-17(9-3-14)28-18-10-4-15(5-11-18)25-20(27)26-16-6-12-19(13-7-16)29-21(22,23)24;1-14-2-10-18(11-3-14)28-19-12-8-17(9-13-19)26-20(27)25-16-6-4-15(5-7-16)21(22,23)24;22-13-15-1-5-17(6-2-15)24-21(26)25-18-7-11-20(12-8-18)27-19-9-3-16(14-23)4-10-19/h7,10-15,17H,3-6,8-9H2,1-2H3,(H2,30,31,34);5-6,9-12,15-16,18H,1-4,7-8,13-14H2,(H2,29,30,33);7-8,11-16,18H,3-6,9-10H2,1-2H3,(H2,29,30,33);4-5,8-13,15H,2-3,6-7H2,1H3,(H,25,29)(H2,27,28,30);2-12H,1H3,(H,25,29)(H2,27,28,30);2-3,6-9,12-13,15,18H,4-5,10-11H2,1H3,(H2,25,26,27);2-7,10-11,17,19H,8-9,12-13H2,1H3,(H2,25,26,27);1-6,9-10,18,20H,7-8,11-12H2,(H2,24,25,26).
What are the key properties of 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea?
4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea has a molecular weight of 3560.05 g/mol, XLogP of 38.95, 46 rotatable bonds, 18 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]cyclohexyl]oxy-N,N-diethylpyridine-2-carboxamide;1-[4-(4-cyanophenoxy)cyclohexyl]-3-(4-cyanophenyl)urea;N,N-diethyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea;1-[4-(4-methylphenoxy)cyclohexyl]-3-[4-(trifluoromethyl)phenyl]urea;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]cyclohexyl]oxypyridine-2-carboxamide;N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide;1-[4-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]oxy]cyclohexyl]-3-[4-(trifluoromethoxy)phenyl]urea is sourced from PubChem (CID 158001971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).