2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide

C134H124F15N31O20S — CID 173078971

IUPAC2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide
SMILESCC(=O)Nc1cc(Oc2ccc3c(c2)CCN3C(=O)Nc2ccc(OC(C)(CNC(=O)Cc3cc(Oc4ccc5c(ccn5C(=O)Nc5ccc(N6CCS(=O)(=O)CC6)c(C(F)(F)F)c5)c4)ncn3)C(=O)O)c(C(F)(F)F)c2)ncn1.CN1CCN(Cc2ccc(NC(=O)n3ccc4cc(Oc5nccc(CC(N)=O)n5)ccc43)cc2C(F)(F)F)CC1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCCC4)c(C(F)(F)F)c3)c2)ncn1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCNCC4)c(C(F)(F)F)c3)c2)ncn1
InChIInChI=1S/C52H45F6N11O11S.C28H28F3N7O3.C27H26F3N7O3.C27H25F3N6O3/c1-29(70)64-43-25-46(63-28-61-43)79-36-6-9-40-31(20-36)12-14-69(40)49(75)66-33-4-10-42(38(22-33)52(56,57)58)80-50(2,47(72)73)26-59-44(71)23-34-24-45(62-27-60-34)78-35-5-8-39-30(19-35)11-13-68(39)48(74)65-32-3-7-41(37(21-32)51(53,54)55)67-15-17-81(76,77)18-16-67;1-36-10-12-37(13-11-36)17-19-2-3-20(15-23(19)28(29,30)31)35-27(40)38-9-7-18-14-22(4-5-24(18)38)41-26-33-8-6-21(34-26)16-25(32)39;28-27(29,30)22-12-19(2-1-18(22)15-36-9-6-32-7-10-36)35-26(39)37-8-5-17-11-21(3-4-23(17)37)40-25-14-20(13-24(31)38)33-16-34-25;28-27(29,30)22-12-19(4-3-18(22)15-35-8-1-2-9-35)34-26(38)36-10-7-17-11-21(5-6-23(17)36)39-25-14-20(13-24(31)37)32-16-33-25/h3-11,13,19-22,24-25,27-28H,12,14-18,23,26H2,1-2H3,(H,59,71)(H,65,74)(H,66,75)(H,72,73)(H,61,63,64,70);2-9,14-15H,10-13,16-17H2,1H3,(H2,32,39)(H,35,40);1-5,8,11-12,14,16,32H,6-7,9-10,13,15H2,(H2,31,38)(H,35,39);3-7,10-12,14,16H,1-2,8-9,13,15H2,(H2,31,37)(H,34,38)
InChIKeyQEXUBVROHXIELZ-UHFFFAOYSA-N
MW2805.70 g/mol
LogP21.09
Rot. Bonds36

About 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide

2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide (PubChem CID 173078971) has the molecular formula C134H124F15N31O20S and a molecular weight of 2805.70 g/mol. Its IUPAC name is 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide.

Molecular Properties

Compound Name2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide
PubChem CID173078971
Molecular FormulaC134H124F15N31O20S
Molecular Weight2805.70 g/mol
Exact Mass2803.91
IUPAC Name2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide
SMILESCC(=O)Nc1cc(Oc2ccc3c(c2)CCN3C(=O)Nc2ccc(OC(C)(CNC(=O)Cc3cc(Oc4ccc5c(ccn5C(=O)Nc5ccc(N6CCS(=O)(=O)CC6)c(C(F)(F)F)c5)c4)ncn3)C(=O)O)c(C(F)(F)F)c2)ncn1.CN1CCN(Cc2ccc(NC(=O)n3ccc4cc(Oc5nccc(CC(N)=O)n5)ccc43)cc2C(F)(F)F)CC1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCCC4)c(C(F)(F)F)c3)c2)ncn1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCNCC4)c(C(F)(F)F)c3)c2)ncn1
InChIInChI=1S/C52H45F6N11O11S.C28H28F3N7O3.C27H26F3N7O3.C27H25F3N6O3/c1-29(70)64-43-25-46(63-28-61-43)79-36-6-9-40-31(20-36)12-14-69(40)49(75)66-33-4-10-42(38(22-33)52(56,57)58)80-50(2,47(72)73)26-59-44(71)23-34-24-45(62-27-60-34)78-35-5-8-39-30(19-35)11-13-68(39)48(74)65-32-3-7-41(37(21-32)51(53,54)55)67-15-17-81(76,77)18-16-67;1-36-10-12-37(13-11-36)17-19-2-3-20(15-23(19)28(29,30)31)35-27(40)38-9-7-18-14-22(4-5-24(18)38)41-26-33-8-6-21(34-26)16-25(32)39;28-27(29,30)22-12-19(2-1-18(22)15-36-9-6-32-7-10-36)35-26(39)37-8-5-17-11-21(3-4-23(17)37)40-25-14-20(13-24(31)38)33-16-34-25;28-27(29,30)22-12-19(4-3-18(22)15-35-8-1-2-9-35)34-26(38)36-10-7-17-11-21(5-6-23(17)36)39-25-14-20(13-24(31)37)32-16-33-25/h3-11,13,19-22,24-25,27-28H,12,14-18,23,26H2,1-2H3,(H,59,71)(H,65,74)(H,66,75)(H,72,73)(H,61,63,64,70);2-9,14-15H,10-13,16-17H2,1H3,(H2,32,39)(H,35,40);1-5,8,11-12,14,16,32H,6-7,9-10,13,15H2,(H2,31,38)(H,35,39);3-7,10-12,14,16H,1-2,8-9,13,15H2,(H2,31,37)(H,34,38)
InChIKeyQEXUBVROHXIELZ-UHFFFAOYSA-N
XLogP21.09
TPSA639.88 Ų
H-Bond Donors12
H-Bond Acceptors39
Rotatable Bonds36
Heavy Atoms201
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002805.70
LogP ≤ 521.09
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide?
The IUPAC name of 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide (CID 173078971) is 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide.
What is the SMILES notation for 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide?
The canonical SMILES for 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide is CC(=O)Nc1cc(Oc2ccc3c(c2)CCN3C(=O)Nc2ccc(OC(C)(CNC(=O)Cc3cc(Oc4ccc5c(ccn5C(=O)Nc5ccc(N6CCS(=O)(=O)CC6)c(C(F)(F)F)c5)c4)ncn3)C(=O)O)c(C(F)(F)F)c2)ncn1.CN1CCN(Cc2ccc(NC(=O)n3ccc4cc(Oc5nccc(CC(N)=O)n5)ccc43)cc2C(F)(F)F)CC1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCCC4)c(C(F)(F)F)c3)c2)ncn1.NC(=O)Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3ccc(CN4CCNCC4)c(C(F)(F)F)c3)c2)ncn1.
What is the InChIKey of 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide?
The InChIKey is QEXUBVROHXIELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H45F6N11O11S.C28H28F3N7O3.C27H26F3N7O3.C27H25F3N6O3/c1-29(70)64-43-25-46(63-28-61-43)79-36-6-9-40-31(20-36)12-14-69(40)49(75)66-33-4-10-42(38(22-33)52(56,57)58)80-50(2,47(72)73)26-59-44(71)23-34-24-45(62-27-60-34)78-35-5-8-39-30(19-35)11-13-68(39)48(74)65-32-3-7-41(37(21-32)51(53,54)55)67-15-17-81(76,77)18-16-67;1-36-10-12-37(13-11-36)17-19-2-3-20(15-23(19)28(29,30)31)35-27(40)38-9-7-18-14-22(4-5-24(18)38)41-26-33-8-6-21(34-26)16-25(32)39;28-27(29,30)22-12-19(2-1-18(22)15-36-9-6-32-7-10-36)35-26(39)37-8-5-17-11-21(3-4-23(17)37)40-25-14-20(13-24(31)38)33-16-34-25;28-27(29,30)22-12-19(4-3-18(22)15-35-8-1-2-9-35)34-26(38)36-10-7-17-11-21(5-6-23(17)36)39-25-14-20(13-24(31)37)32-16-33-25/h3-11,13,19-22,24-25,27-28H,12,14-18,23,26H2,1-2H3,(H,59,71)(H,65,74)(H,66,75)(H,72,73)(H,61,63,64,70);2-9,14-15H,10-13,16-17H2,1H3,(H2,32,39)(H,35,40);1-5,8,11-12,14,16,32H,6-7,9-10,13,15H2,(H2,31,38)(H,35,39);3-7,10-12,14,16H,1-2,8-9,13,15H2,(H2,31,37)(H,34,38).
What are the key properties of 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide?
2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide has a molecular weight of 2805.70 g/mol, XLogP of 21.09, 36 rotatable bonds, 12 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[5-(6-acetamidopyrimidin-4-yl)oxy-2,3-dihydroindole-1-carbonyl]amino]-2-(trifluoromethyl)phenoxy]-3-[[2-[6-[1-[[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(trifluoromethyl)phenyl]carbamoyl]indol-5-yl]oxypyrimidin-4-yl]acetyl]amino]-2-methylpropanoic acid;5-[4-(2-amino-2-oxoethyl)pyrimidin-2-yl]oxy-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]indole-1-carboxamide is sourced from PubChem (CID 173078971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).