1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol

C115H152ClN17O17 — CID 158524959

IUPAC1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
SMILESCCCCN(CCOC)c1cc(-c2ccc(OC)c(OC)c2)nc(-c2cccc(OCC(O)CNC)c2)n1.CCCCN(CCOC)c1cc(-c2ccc3c(c2)OCCO3)nc(-c2cccc(OCC(O)CNC)c2)n1.CCc1ccc(-c2cc(N(C)C3CCOCC3)nc(-c3cccc(OCC(O)CNC)c3)n2)cc1OC.CNCC(O)COc1cc(Cl)cc(-c2nc(-c3cc(C)nc(C)c3)c(C)c(N(C)C3CCOCC3)n2)c1
InChIInChI=1S/C29H38N4O5.C29H40N4O5.C29H38N4O4.C28H36ClN5O3/c1-4-5-11-33(12-13-35-3)28-18-25(21-9-10-26-27(17-21)37-15-14-36-26)31-29(32-28)22-7-6-8-24(16-22)38-20-23(34)19-30-2;1-6-7-13-33(14-15-35-3)28-18-25(21-11-12-26(36-4)27(17-21)37-5)31-29(32-28)22-9-8-10-24(16-22)38-20-23(34)19-30-2;1-5-20-9-10-21(16-27(20)35-4)26-17-28(33(3)23-11-13-36-14-12-23)32-29(31-26)22-7-6-8-25(15-22)37-19-24(34)18-30-2;1-17-10-20(11-18(2)31-17)26-19(3)28(34(5)23-6-8-36-9-7-23)33-27(32-26)21-12-22(29)14-25(13-21)37-16-24(35)15-30-4/h6-10,16-18,23,30,34H,4-5,11-15,19-20H2,1-3H3;8-12,16-18,23,30,34H,6-7,13-15,19-20H2,1-5H3;6-10,15-17,23-24,30,34H,5,11-14,18-19H2,1-4H3;10-14,23-24,30,35H,6-9,15-16H2,1-5H3
InChIKeyHMRHHOOUSUUGNB-UHFFFAOYSA-N
MW2080.04 g/mol
LogP16.15
Rot. Bonds50

About 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol

1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol (PubChem CID 158524959) has the molecular formula C115H152ClN17O17 and a molecular weight of 2080.04 g/mol. Its IUPAC name is 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Name1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
PubChem CID158524959
Molecular FormulaC115H152ClN17O17
Molecular Weight2080.04 g/mol
Exact Mass2078.12
IUPAC Name1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
SMILESCCCCN(CCOC)c1cc(-c2ccc(OC)c(OC)c2)nc(-c2cccc(OCC(O)CNC)c2)n1.CCCCN(CCOC)c1cc(-c2ccc3c(c2)OCCO3)nc(-c2cccc(OCC(O)CNC)c2)n1.CCc1ccc(-c2cc(N(C)C3CCOCC3)nc(-c3cccc(OCC(O)CNC)c3)n2)cc1OC.CNCC(O)COc1cc(Cl)cc(-c2nc(-c3cc(C)nc(C)c3)c(C)c(N(C)C3CCOCC3)n2)c1
InChIInChI=1S/C29H38N4O5.C29H40N4O5.C29H38N4O4.C28H36ClN5O3/c1-4-5-11-33(12-13-35-3)28-18-25(21-9-10-26-27(17-21)37-15-14-36-26)31-29(32-28)22-7-6-8-24(16-22)38-20-23(34)19-30-2;1-6-7-13-33(14-15-35-3)28-18-25(21-11-12-26(36-4)27(17-21)37-5)31-29(32-28)22-9-8-10-24(16-22)38-20-23(34)19-30-2;1-5-20-9-10-21(16-27(20)35-4)26-17-28(33(3)23-11-13-36-14-12-23)32-29(31-26)22-7-6-8-25(15-22)37-19-24(34)18-30-2;1-17-10-20(11-18(2)31-17)26-19(3)28(34(5)23-6-8-36-9-7-23)33-27(32-26)21-12-22(29)14-25(13-21)37-16-24(35)15-30-4/h6-10,16-18,23,30,34H,4-5,11-15,19-20H2,1-3H3;8-12,16-18,23,30,34H,6-7,13-15,19-20H2,1-5H3;6-10,15-17,23-24,30,34H,5,11-14,18-19H2,1-4H3;10-14,23-24,30,35H,6-9,15-16H2,1-5H3
InChIKeyHMRHHOOUSUUGNB-UHFFFAOYSA-N
XLogP16.15
TPSA378.00 Ų
H-Bond Donors8
H-Bond Acceptors34
Rotatable Bonds50
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002080.04
LogP ≤ 516.15
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1034

Analyze 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol with MolForge

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Related Compounds

US10633389, Example 74-1
CID 85473057
US10633389, Example 75-1
CID 85473058
1-[3-[[2-[3-[[4-[6-[Bis(2-methoxyethyl)amino]-2-[3-chloro-5-[2-hydroxy-3-(methylamino)propoxy]phenyl]pyrimidin-4-yl]-2-pyridinyl]oxymethyl]-5-[2-hydroxy-3-(methylamino)propoxy]phenyl]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-4-yl]amino]propyl]-3-[2-[[2-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]-6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-yl]-(2-methoxyethyl)amino]ethoxy]pyrrolidin-2-one
CID 123198911
1-[3-Chloro-5-[4-[cyclohexyl(methyl)amino]-6-[6-(dimethylamino)-3-pyridinyl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-[cyclohexyl(methyl)amino]-5-methyl-6-quinoxalin-2-ylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[cyclohexyl(methyl)amino]-6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-cyclohexyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
CID 159032682
1-[3-[4-[Butyl(2-methoxyethyl)amino]-6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(1,5-dimethoxypentan-3-yl)-6-(2-methoxy-4-pyridinyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one;1-[3-[[6-(3,4-dimethoxyphenyl)-2-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one
CID 159539067
1-[3-[4-[Bis(2-methoxyethyl)amino]-6-(2-methoxy-4-pyridinyl)pyrimidin-2-yl]-5-chlorophenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one
CID 160808940
1-(2,3-dimethoxyphenyl)-N-[[5-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methyl]methanamine
CID 59776879
1-(2,3-dimethoxyphenyl)-N-[[5-[2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methyl]methanamine
CID 68435564
1-[3-[4-[Butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-5-chlorophenoxy]-3-(methylamino)propan-2-ol
CID 117606878
1-[3-[4-[Butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]-5-chlorophenoxy]-3-(methylamino)propan-2-ol
CID 117606916
1-[3-[4-[3-[4-[[2-[3-Chloro-5-[2-hydroxy-3-(methylamino)propoxy]phenyl]-6-pyridin-4-ylpyrimidin-4-yl]amino]piperidin-2-yl]-4-pyridinyl]-6-(piperidin-4-ylamino)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
CID 123237215
1-[3-[4-(2,3-Dihydro-1,4-benzodioxin-6-yl)-6-[2-[[4-[[6-(3,4-dimethoxyphenyl)-2-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]pyrimidin-4-yl]-methylamino]oxan-3-yl]methoxy]ethyl-(2-methoxyethyl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
CID 138620341

Frequently Asked Questions

What is the IUPAC name of 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?
The IUPAC name of 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol (CID 158524959) is 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol.
What is the SMILES notation for 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?
The canonical SMILES for 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol is CCCCN(CCOC)c1cc(-c2ccc(OC)c(OC)c2)nc(-c2cccc(OCC(O)CNC)c2)n1.CCCCN(CCOC)c1cc(-c2ccc3c(c2)OCCO3)nc(-c2cccc(OCC(O)CNC)c2)n1.CCc1ccc(-c2cc(N(C)C3CCOCC3)nc(-c3cccc(OCC(O)CNC)c3)n2)cc1OC.CNCC(O)COc1cc(Cl)cc(-c2nc(-c3cc(C)nc(C)c3)c(C)c(N(C)C3CCOCC3)n2)c1.
What is the InChIKey of 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?
The InChIKey is HMRHHOOUSUUGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H38N4O5.C29H40N4O5.C29H38N4O4.C28H36ClN5O3/c1-4-5-11-33(12-13-35-3)28-18-25(21-9-10-26-27(17-21)37-15-14-36-26)31-29(32-28)22-7-6-8-24(16-22)38-20-23(34)19-30-2;1-6-7-13-33(14-15-35-3)28-18-25(21-11-12-26(36-4)27(17-21)37-5)31-29(32-28)22-9-8-10-24(16-22)38-20-23(34)19-30-2;1-5-20-9-10-21(16-27(20)35-4)26-17-28(33(3)23-11-13-36-14-12-23)32-29(31-26)22-7-6-8-25(15-22)37-19-24(34)18-30-2;1-17-10-20(11-18(2)31-17)26-19(3)28(34(5)23-6-8-36-9-7-23)33-27(32-26)21-12-22(29)14-25(13-21)37-16-24(35)15-30-4/h6-10,16-18,23,30,34H,4-5,11-15,19-20H2,1-3H3;8-12,16-18,23,30,34H,6-7,13-15,19-20H2,1-5H3;6-10,15-17,23-24,30,34H,5,11-14,18-19H2,1-4H3;10-14,23-24,30,35H,6-9,15-16H2,1-5H3.
What are the key properties of 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?
1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol has a molecular weight of 2080.04 g/mol, XLogP of 16.15, 50 rotatable bonds, 8 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-[butyl(2-methoxyethyl)amino]-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-chloro-5-[4-(2,6-dimethyl-4-pyridinyl)-5-methyl-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(4-ethyl-3-methoxyphenyl)-6-[methyl(oxan-4-yl)amino]pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol is sourced from PubChem (CID 158524959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).