5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate

C110H114F7N29O11S7 — CID 161241681

IUPAC5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate
SMILESCC(C)(c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1)C(F)(F)F.CC(F)(F)S(=O)(=O)c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1.Cc1nnc2sc(C(=O)N3CC(NC(=O)OCc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCCn4nccc43)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(=O)n(C)c3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(C(C)(F)F)nc3)c(N)c2c1C
InChIInChI=1S/C22H23F3N4OS.C20H20F2N4O3S2.C20H21N5O3S.C17H17F2N5OS.C16H17N5O2S.C15H16N6OS/c1-21(2,22(23,24)25)13-9-7-12(8-10-13)11-27-19(30)18-17(26)16-14-5-3-4-6-15(14)28-29-20(16)31-18;1-20(21,22)31(28,29)12-8-6-11(7-9-12)10-24-18(27)17-16(23)15-13-4-2-3-5-14(13)25-26-19(15)30-17;1-11-12(2)23-24-18-15(11)16(21)17(29-18)19(26)25-8-14(9-25)22-20(27)28-10-13-6-4-3-5-7-13;1-8-9(2)23-24-16-12(8)13(20)14(26-16)15(25)22-7-10-4-5-11(21-6-10)17(3,18)19;1-8-9(2)19-20-16-12(8)13(17)14(24-16)15(23)18-6-10-4-5-11(22)21(3)7-10;1-8-9(2)18-19-14-11(8)12(16)13(23-14)15(22)20-6-3-7-21-10(20)4-5-17-21/h7-10H,3-6,11,26H2,1-2H3,(H,27,30);6-9H,2-5,10,23H2,1H3,(H,24,27);3-7,14H,8-10,21H2,1-2H3,(H,22,27);4-6H,7,20H2,1-3H3,(H,22,25);4-5,7H,6,17H2,1-3H3,(H,18,23);4-5H,3,6-7,16H2,1-2H3
InChIKeyVACARDJZJZENGP-UHFFFAOYSA-N
MW2375.77 g/mol
LogP18.02
Rot. Bonds21

About 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate

5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate (PubChem CID 161241681) has the molecular formula C110H114F7N29O11S7 and a molecular weight of 2375.77 g/mol. Its IUPAC name is 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate.

Molecular Properties

Compound Name5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate
PubChem CID161241681
Molecular FormulaC110H114F7N29O11S7
Molecular Weight2375.77 g/mol
Exact Mass2373.72
IUPAC Name5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate
SMILESCC(C)(c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1)C(F)(F)F.CC(F)(F)S(=O)(=O)c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1.Cc1nnc2sc(C(=O)N3CC(NC(=O)OCc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCCn4nccc43)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(=O)n(C)c3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(C(C)(F)F)nc3)c(N)c2c1C
InChIInChI=1S/C22H23F3N4OS.C20H20F2N4O3S2.C20H21N5O3S.C17H17F2N5OS.C16H17N5O2S.C15H16N6OS/c1-21(2,22(23,24)25)13-9-7-12(8-10-13)11-27-19(30)18-17(26)16-14-5-3-4-6-15(14)28-29-20(16)31-18;1-20(21,22)31(28,29)12-8-6-11(7-9-12)10-24-18(27)17-16(23)15-13-4-2-3-5-14(13)25-26-19(15)30-17;1-11-12(2)23-24-18-15(11)16(21)17(29-18)19(26)25-8-14(9-25)22-20(27)28-10-13-6-4-3-5-7-13;1-8-9(2)23-24-16-12(8)13(20)14(26-16)15(25)22-7-10-4-5-11(21-6-10)17(3,18)19;1-8-9(2)19-20-16-12(8)13(17)14(24-16)15(23)18-6-10-4-5-11(22)21(3)7-10;1-8-9(2)18-19-14-11(8)12(16)13(23-14)15(22)20-6-3-7-21-10(20)4-5-17-21/h7-10H,3-6,11,26H2,1-2H3,(H,27,30);6-9H,2-5,10,23H2,1H3,(H,24,27);3-7,14H,8-10,21H2,1-2H3,(H,22,27);4-6H,7,20H2,1-3H3,(H,22,25);4-5,7H,6,17H2,1-3H3,(H,18,23);4-5H,3,6-7,16H2,1-2H3
InChIKeyVACARDJZJZENGP-UHFFFAOYSA-N
XLogP18.02
TPSA593.00 Ų
H-Bond Donors11
H-Bond Acceptors39
Rotatable Bonds21
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002375.77
LogP ≤ 518.02
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1039

Analyze 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate with MolForge

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Related Compounds

5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
CID 122691528
5-amino-3,4-dimethyl-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide
CID 122691524
5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
CID 158019964
(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-fluorophenyl)methylamino]azetidin-1-yl]methanone
CID 71735834
5-amino-N-[1-[4-(1,1-difluoroethoxy)phenyl]pyrrolidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
CID 122691440
5-amino-N-[[4-fluoro-3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
CID 158177549
6-amino-N-[(4-methoxyphenyl)methyl]-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraene-5-carboxamide
CID 1005644
(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(benzenesulfonyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone
CID 158393556
5-amino-3,4-dimethyl-N-[1-(5-methylpyrimidin-2-yl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide
CID 122691516
5-amino-3,4-dimethyl-N-[[4-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2-fluoro-3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide
CID 159713596
3-amino-N-benzyl-4-methyl-6-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carboxamide
CID 45142481
benzyl N-(1-acetylazetidin-3-yl)carbamate
CID 118370546

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate?
The IUPAC name of 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate (CID 161241681) is 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate.
What is the SMILES notation for 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate?
The canonical SMILES for 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate is CC(C)(c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1)C(F)(F)F.CC(F)(F)S(=O)(=O)c1ccc(CNC(=O)c2sc3nnc4c(c3c2N)CCCC4)cc1.Cc1nnc2sc(C(=O)N3CC(NC(=O)OCc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCCn4nccc43)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(=O)n(C)c3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(C(C)(F)F)nc3)c(N)c2c1C.
What is the InChIKey of 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate?
The InChIKey is VACARDJZJZENGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23F3N4OS.C20H20F2N4O3S2.C20H21N5O3S.C17H17F2N5OS.C16H17N5O2S.C15H16N6OS/c1-21(2,22(23,24)25)13-9-7-12(8-10-13)11-27-19(30)18-17(26)16-14-5-3-4-6-15(14)28-29-20(16)31-18;1-20(21,22)31(28,29)12-8-6-11(7-9-12)10-24-18(27)17-16(23)15-13-4-2-3-5-14(13)25-26-19(15)30-17;1-11-12(2)23-24-18-15(11)16(21)17(29-18)19(26)25-8-14(9-25)22-20(27)28-10-13-6-4-3-5-7-13;1-8-9(2)23-24-16-12(8)13(20)14(26-16)15(25)22-7-10-4-5-11(21-6-10)17(3,18)19;1-8-9(2)19-20-16-12(8)13(17)14(24-16)15(23)18-6-10-4-5-11(22)21(3)7-10;1-8-9(2)18-19-14-11(8)12(16)13(23-14)15(22)20-6-3-7-21-10(20)4-5-17-21/h7-10H,3-6,11,26H2,1-2H3,(H,27,30);6-9H,2-5,10,23H2,1H3,(H,24,27);3-7,14H,8-10,21H2,1-2H3,(H,22,27);4-6H,7,20H2,1-3H3,(H,22,25);4-5,7H,6,17H2,1-3H3,(H,18,23);4-5H,3,6-7,16H2,1-2H3.
What are the key properties of 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate?
5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate has a molecular weight of 2375.77 g/mol, XLogP of 18.02, 21 rotatable bonds, 11 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;1-amino-N-[[4-(1,1-difluoroethylsulfonyl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;5-amino-3,4-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)methanone;1-amino-N-[[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]methyl]-6,7,8,9-tetrahydrothieno[2,3-c]cinnoline-2-carboxamide;benzyl N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)azetidin-3-yl]carbamate is sourced from PubChem (CID 161241681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).