N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate

C136H156FN29O25S6 — CID 161499476

IUPACN-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate
SMILESCCOc1cc(C(N)=O)ccc1Nc1ncnc2sc(C(=O)OC)c(C)c12.CN(C)CCCNC(=O)c1cc2c(Nc3ccc(F)cc3OC3CCOCC3)ncnc2s1.COC(=O)c1sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c2c1C.COC(=O)c1sc2ncnc(Nc3ccc(C)nc3OC3CCOCC3)c2c1C.Cc1c(C(=O)NCCCN(C)C)sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c12.Cc1ccc(Nc2ncnc3sc(C(=O)NCCCN(C)C)c(C)c23)c(OC2CCOCC2)n1.O=CO
InChIInChI=1S/C27H32N6O4S.C24H32N6O3S.C23H28FN5O3S.C23H22N4O5S.C20H22N4O4S.C18H18N4O4S.CH2O2/c1-17-22-24(29-16-30-27(22)38-23(17)25(34)28-10-4-11-33(2)3)31-21-6-5-20(18-7-12-36-15-18)32-26(21)37-19-8-13-35-14-9-19;1-15-6-7-18(23(28-15)33-17-8-12-32-13-9-17)29-21-19-16(2)20(34-24(19)27-14-26-21)22(31)25-10-5-11-30(3)4;1-29(2)9-3-8-25-22(30)20-13-17-21(26-14-27-23(17)33-20)28-18-5-4-15(24)12-19(18)32-16-6-10-31-11-7-16;1-13-18-20(24-12-25-22(18)33-19(13)23(28)29-2)26-17-4-3-16(14-5-8-31-11-14)27-21(17)32-15-6-9-30-10-7-15;1-11-4-5-14(18(23-11)28-13-6-8-27-9-7-13)24-17-15-12(2)16(20(25)26-3)29-19(15)22-10-21-17;1-4-26-12-7-10(15(19)23)5-6-11(12)22-16-13-9(2)14(18(24)25-3)27-17(13)21-8-20-16;2-1-3/h5-7,12,15-16,19H,4,8-11,13-14H2,1-3H3,(H,28,34)(H,29,30,31);6-7,14,17H,5,8-13H2,1-4H3,(H,25,31)(H,26,27,29);4-5,12-14,16H,3,6-11H2,1-2H3,(H,25,30)(H,26,27,28);3-5,8,11-12,15H,6-7,9-10H2,1-2H3,(H,24,25,26);4-5,10,13H,6-9H2,1-3H3,(H,21,22,24);5-8H,4H2,1-3H3,(H2,19,23)(H,20,21,22);1H,(H,2,3)
InChIKeyWGQLNZONFBKIOE-UHFFFAOYSA-N
MW2808.32 g/mol
LogP23.40
Rot. Bonds45

About N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate

N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate (PubChem CID 161499476) has the molecular formula C136H156FN29O25S6 and a molecular weight of 2808.32 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate
PubChem CID161499476
Molecular FormulaC136H156FN29O25S6
Molecular Weight2808.32 g/mol
Exact Mass2806.01
IUPAC NameN-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate
SMILESCCOc1cc(C(N)=O)ccc1Nc1ncnc2sc(C(=O)OC)c(C)c12.CN(C)CCCNC(=O)c1cc2c(Nc3ccc(F)cc3OC3CCOCC3)ncnc2s1.COC(=O)c1sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c2c1C.COC(=O)c1sc2ncnc(Nc3ccc(C)nc3OC3CCOCC3)c2c1C.Cc1c(C(=O)NCCCN(C)C)sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c12.Cc1ccc(Nc2ncnc3sc(C(=O)NCCCN(C)C)c(C)c23)c(OC2CCOCC2)n1.O=CO
InChIInChI=1S/C27H32N6O4S.C24H32N6O3S.C23H28FN5O3S.C23H22N4O5S.C20H22N4O4S.C18H18N4O4S.CH2O2/c1-17-22-24(29-16-30-27(22)38-23(17)25(34)28-10-4-11-33(2)3)31-21-6-5-20(18-7-12-36-15-18)32-26(21)37-19-8-13-35-14-9-19;1-15-6-7-18(23(28-15)33-17-8-12-32-13-9-17)29-21-19-16(2)20(34-24(19)27-14-26-21)22(31)25-10-5-11-30(3)4;1-29(2)9-3-8-25-22(30)20-13-17-21(26-14-27-23(17)33-20)28-18-5-4-15(24)12-19(18)32-16-6-10-31-11-7-16;1-13-18-20(24-12-25-22(18)33-19(13)23(28)29-2)26-17-4-3-16(14-5-8-31-11-14)27-21(17)32-15-6-9-30-10-7-15;1-11-4-5-14(18(23-11)28-13-6-8-27-9-7-13)24-17-15-12(2)16(20(25)26-3)29-19(15)22-10-21-17;1-4-26-12-7-10(15(19)23)5-6-11(12)22-16-13-9(2)14(18(24)25-3)27-17(13)21-8-20-16;2-1-3/h5-7,12,15-16,19H,4,8-11,13-14H2,1-3H3,(H,28,34)(H,29,30,31);6-7,14,17H,5,8-13H2,1-4H3,(H,25,31)(H,26,27,29);4-5,12-14,16H,3,6-11H2,1-2H3,(H,25,30)(H,26,27,28);3-5,8,11-12,15H,6-7,9-10H2,1-2H3,(H,24,25,26);4-5,10,13H,6-9H2,1-3H3,(H,21,22,24);5-8H,4H2,1-3H3,(H2,19,23)(H,20,21,22);1H,(H,2,3)
InChIKeyWGQLNZONFBKIOE-UHFFFAOYSA-N
XLogP23.40
TPSA662.54 Ų
H-Bond Donors11
H-Bond Acceptors55
Rotatable Bonds45
Heavy Atoms197
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002808.32
LogP ≤ 523.40
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1055

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate?
The IUPAC name of N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate (CID 161499476) is N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate?
The canonical SMILES for N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate is CCOc1cc(C(N)=O)ccc1Nc1ncnc2sc(C(=O)OC)c(C)c12.CN(C)CCCNC(=O)c1cc2c(Nc3ccc(F)cc3OC3CCOCC3)ncnc2s1.COC(=O)c1sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c2c1C.COC(=O)c1sc2ncnc(Nc3ccc(C)nc3OC3CCOCC3)c2c1C.Cc1c(C(=O)NCCCN(C)C)sc2ncnc(Nc3ccc(-c4ccoc4)nc3OC3CCOCC3)c12.Cc1ccc(Nc2ncnc3sc(C(=O)NCCCN(C)C)c(C)c23)c(OC2CCOCC2)n1.O=CO.
What is the InChIKey of N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate?
The InChIKey is WGQLNZONFBKIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N6O4S.C24H32N6O3S.C23H28FN5O3S.C23H22N4O5S.C20H22N4O4S.C18H18N4O4S.CH2O2/c1-17-22-24(29-16-30-27(22)38-23(17)25(34)28-10-4-11-33(2)3)31-21-6-5-20(18-7-12-36-15-18)32-26(21)37-19-8-13-35-14-9-19;1-15-6-7-18(23(28-15)33-17-8-12-32-13-9-17)29-21-19-16(2)20(34-24(19)27-14-26-21)22(31)25-10-5-11-30(3)4;1-29(2)9-3-8-25-22(30)20-13-17-21(26-14-27-23(17)33-20)28-18-5-4-15(24)12-19(18)32-16-6-10-31-11-7-16;1-13-18-20(24-12-25-22(18)33-19(13)23(28)29-2)26-17-4-3-16(14-5-8-31-11-14)27-21(17)32-15-6-9-30-10-7-15;1-11-4-5-14(18(23-11)28-13-6-8-27-9-7-13)24-17-15-12(2)16(20(25)26-3)29-19(15)22-10-21-17;1-4-26-12-7-10(15(19)23)5-6-11(12)22-16-13-9(2)14(18(24)25-3)27-17(13)21-8-20-16;2-1-3/h5-7,12,15-16,19H,4,8-11,13-14H2,1-3H3,(H,28,34)(H,29,30,31);6-7,14,17H,5,8-13H2,1-4H3,(H,25,31)(H,26,27,29);4-5,12-14,16H,3,6-11H2,1-2H3,(H,25,30)(H,26,27,28);3-5,8,11-12,15H,6-7,9-10H2,1-2H3,(H,24,25,26);4-5,10,13H,6-9H2,1-3H3,(H,21,22,24);5-8H,4H2,1-3H3,(H2,19,23)(H,20,21,22);1H,(H,2,3).
What are the key properties of N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate?
N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate has a molecular weight of 2808.32 g/mol, XLogP of 23.40, 45 rotatable bonds, 11 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-4-[4-fluoro-2-(oxan-4-yloxy)anilino]thieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide;N-[3-(dimethylamino)propyl]-5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxamide;formic acid;methyl 4-(4-carbamoyl-2-ethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 4-[[6-(furan-3-yl)-2-(oxan-4-yloxy)-3-pyridinyl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate;methyl 5-methyl-4-[[6-methyl-2-(oxan-4-yloxy)-3-pyridinyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate is sourced from PubChem (CID 161499476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).