4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine

C135H143N23O16 — CID 158886024

IUPAC4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine
SMILESCOc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)C4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)CC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCNCC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCOCC4)c3C1)CO2.Nc1nccc(-c2cc3c(c(OC4CCOCC4)c2)CC(C2COc4ccccc4C2)=N3)n1
InChIInChI=1S/C28H31N5O3.2C27H29N5O3.C27H28N4O4.C26H26N4O3/c1-33-9-6-20(7-10-33)36-27-14-17(23-5-8-30-28(29)32-23)13-25-22(27)15-24(31-25)19-11-18-12-21(34-2)3-4-26(18)35-16-19;1-32-8-6-20(14-32)35-26-12-16(22-5-7-29-27(28)31-22)11-24-21(26)13-23(30-24)18-9-17-10-19(33-2)3-4-25(17)34-15-18;1-33-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(31-23)12-16(22-6-9-30-27(28)32-22)13-26(21)35-19-4-7-29-8-5-19;1-32-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(30-23)12-16(22-4-7-29-27(28)31-22)13-26(21)35-19-5-8-33-9-6-19;27-26-28-8-5-21(30-26)17-12-23-20(25(13-17)33-19-6-9-31-10-7-19)14-22(29-23)18-11-16-3-1-2-4-24(16)32-15-18/h3-5,8,12-14,19-20H,6-7,9-11,15-16H2,1-2H3,(H2,29,30,32);3-5,7,10-12,18,20H,6,8-9,13-15H2,1-2H3,(H2,28,29,31);2-3,6,9,11-13,18-19,29H,4-5,7-8,10,14-15H2,1H3,(H2,28,30,32);2-4,7,11-13,18-19H,5-6,8-10,14-15H2,1H3,(H2,28,29,31);1-5,8,12-13,18-19H,6-7,9-11,14-15H2,(H2,27,28,30)
InChIKeyJDQHFIQYYLUFAN-UHFFFAOYSA-N
MW2343.77 g/mol
LogP19.87
Rot. Bonds24

About 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine

4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine (PubChem CID 158886024) has the molecular formula C135H143N23O16 and a molecular weight of 2343.77 g/mol. Its IUPAC name is 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine
PubChem CID158886024
Molecular FormulaC135H143N23O16
Molecular Weight2343.77 g/mol
Exact Mass2342.11
IUPAC Name4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine
SMILESCOc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)C4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)CC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCNCC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCOCC4)c3C1)CO2.Nc1nccc(-c2cc3c(c(OC4CCOCC4)c2)CC(C2COc4ccccc4C2)=N3)n1
InChIInChI=1S/C28H31N5O3.2C27H29N5O3.C27H28N4O4.C26H26N4O3/c1-33-9-6-20(7-10-33)36-27-14-17(23-5-8-30-28(29)32-23)13-25-22(27)15-24(31-25)19-11-18-12-21(34-2)3-4-26(18)35-16-19;1-32-8-6-20(14-32)35-26-12-16(22-5-7-29-27(28)31-22)11-24-21(26)13-23(30-24)18-9-17-10-19(33-2)3-4-25(17)34-15-18;1-33-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(31-23)12-16(22-6-9-30-27(28)32-22)13-26(21)35-19-4-7-29-8-5-19;1-32-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(30-23)12-16(22-4-7-29-27(28)31-22)13-26(21)35-19-5-8-33-9-6-19;27-26-28-8-5-21(30-26)17-12-23-20(25(13-17)33-19-6-9-31-10-7-19)14-22(29-23)18-11-16-3-1-2-4-24(16)32-15-18/h3-5,8,12-14,19-20H,6-7,9-11,15-16H2,1-2H3,(H2,29,30,32);3-5,7,10-12,18,20H,6,8-9,13-15H2,1-2H3,(H2,28,29,31);2-3,6,9,11-13,18-19,29H,4-5,7-8,10,14-15H2,1H3,(H2,28,30,32);2-4,7,11-13,18-19H,5-6,8-10,14-15H2,1H3,(H2,28,29,31);1-5,8,12-13,18-19H,6-7,9-11,14-15H2,(H2,27,28,30)
InChIKeyJDQHFIQYYLUFAN-UHFFFAOYSA-N
XLogP19.87
TPSA486.99 Ų
H-Bond Donors6
H-Bond Acceptors39
Rotatable Bonds24
Heavy Atoms174
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002343.77
LogP ≤ 519.87
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1039

Analyze 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine with MolForge

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Related Compounds

4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxolan-3-ylmethoxy)-3H-indol-6-yl]pyrimidin-2-amine
CID 58164087
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-[(1-methylpyrrolidin-3-yl)methoxy]-3H-indol-6-yl]pyrimidin-2-amine
CID 58164093
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine
CID 58164148
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine
CID 58164181
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine
CID 58164193
4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(2-morpholin-4-ylethoxy)-3H-indol-6-yl]pyrimidin-2-amine
CID 58164204
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine
CID 58164215
4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(2-morpholin-4-ylethoxy)-3H-indol-6-yl]pyrimidin-2-amine
CID 58164324
N',N'-diethyl-N-[2-[[(16E)-9-[(16Z)-13-oxa-5,7,19,28-tetrazapentacyclo[17.5.2.12,6.18,12.022,26]octacosa-1(25),2(28),3,5,8(27),9,11,16,20,22(26),23-undecaen-21-yl]-14-oxa-5,7,19,28-tetrazapentacyclo[17.5.2.12,6.18,12.022,26]octacosa-1(25),2(28),3,5,8,10,12(27),16,20,22(26),23-undecaen-11-yl]oxy]ethyl]ethane-1,2-diamine
CID 143673714
(16E)-10-(2-imidazol-1-ylethoxy)-3-methyl-20-methylidene-7-[(16E)-3-methyl-10-(2-morpholin-4-ylethoxy)-14,19-dioxa-5,7,22,27-tetrazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2(27),3,5,8,10,12(26),16,21,23-decaen-18-yl]-14-oxa-5,7,23,28-tetrazatetracyclo[20.3.1.12,6.18,12]octacosa-1(26),2(28),3,5,8,10,12(27),16,22,24-decaene
CID 145514106
methane;4-[1-[4-[2-[[(E)-5-[[4-(5-methoxypyrimidin-4-yl)-2-pyridinyl]oxy]pent-2-enoxy]methyl]-4-methylphenyl]piperazin-1-yl]ethenyl]morpholine;(16E)-3-methyl-10-(2-pyrrolidin-1-ylethoxy)-14-oxa-5,7,22,27-tetrazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2(27),3,5,8,10,12(26),16,21,23-decaene
CID 145514116
N,N-diethyl-2-[[(16E)-21-methoxy-14,19-dioxa-5,7,26-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,16,20,22-decaen-11-yl]oxy]ethanamine;2-[[(16E)-14,19-dioxa-5,7,27-triazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(24),2(27),3,5,8(26),9,11,16,21(25),22-decaen-11-yl]oxy]-N,N-diethylethanamine;(15E)-13,19-dioxa-5,7,26-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,15,20,22-decaene;2-[[(16E)-14,19-dioxa-5,7,26-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,16,20,22-decaen-11-yl]oxy]-N,N-diethylethanamine;(16E)-22-methoxy-11-(2-pyrrolidin-1-ylethoxy)-14,19-dioxa-5,7,27-triazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2(27),3,5,8(26),9,11,16,21,23-decaene;(16E)-11-(2-pyrrolidin-1-ylethoxy)-14,19-dioxa-5,7,27-triazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(24),2(27),3,5,8(26),9,11,16,21(25),22-decaene
CID 157054440

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine?
The IUPAC name of 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine (CID 158886024) is 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine?
The canonical SMILES for 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine is COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)C4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCN(C)CC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCNCC4)c3C1)CO2.COc1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)cc(OC4CCOCC4)c3C1)CO2.Nc1nccc(-c2cc3c(c(OC4CCOCC4)c2)CC(C2COc4ccccc4C2)=N3)n1.
What is the InChIKey of 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine?
The InChIKey is JDQHFIQYYLUFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31N5O3.2C27H29N5O3.C27H28N4O4.C26H26N4O3/c1-33-9-6-20(7-10-33)36-27-14-17(23-5-8-30-28(29)32-23)13-25-22(27)15-24(31-25)19-11-18-12-21(34-2)3-4-26(18)35-16-19;1-32-8-6-20(14-32)35-26-12-16(22-5-7-29-27(28)31-22)11-24-21(26)13-23(30-24)18-9-17-10-19(33-2)3-4-25(17)34-15-18;1-33-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(31-23)12-16(22-6-9-30-27(28)32-22)13-26(21)35-19-4-7-29-8-5-19;1-32-20-2-3-25-17(11-20)10-18(15-34-25)23-14-21-24(30-23)12-16(22-4-7-29-27(28)31-22)13-26(21)35-19-5-8-33-9-6-19;27-26-28-8-5-21(30-26)17-12-23-20(25(13-17)33-19-6-9-31-10-7-19)14-22(29-23)18-11-16-3-1-2-4-24(16)32-15-18/h3-5,8,12-14,19-20H,6-7,9-11,15-16H2,1-2H3,(H2,29,30,32);3-5,7,10-12,18,20H,6,8-9,13-15H2,1-2H3,(H2,28,29,31);2-3,6,9,11-13,18-19,29H,4-5,7-8,10,14-15H2,1H3,(H2,28,30,32);2-4,7,11-13,18-19H,5-6,8-10,14-15H2,1H3,(H2,28,29,31);1-5,8,12-13,18-19H,6-7,9-11,14-15H2,(H2,27,28,30).
What are the key properties of 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine?
4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine has a molecular weight of 2343.77 g/mol, XLogP of 19.87, 24 rotatable bonds, 6 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpiperidin-4-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(1-methylpyrrolidin-3-yl)oxy-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-(oxan-4-yloxy)-3H-indol-6-yl]pyrimidin-2-amine;4-[2-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)-4-piperidin-4-yloxy-3H-indol-6-yl]pyrimidin-2-amine is sourced from PubChem (CID 158886024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).