(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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C105H112F2N26O10S8 — CID 161040192

About (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

(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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 161040192) has the molecular formula C105H112F2N26O10S8 and a molecular weight of 2192.75 g/mol. Its IUPAC name is (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 161040192
• Molecular Formula: C105H112F2N26O10S8
• Molecular Weight: 2192.75 g/mol
• Exact Mass: 2190.68
• IUPAC Name: (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: C=C(C)NC1CN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)ccc1O.Cc1ccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1F.Cc1nnc2sc(C(=O)N3CC(S(=O)(=O)c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(OC(C)F)nc3)c(N)c2c1C
• InChI: InChI=1S/C19H19FN4OS2.C19H20N4OS.C18H18N4O3S2.C17H18FN5O2S.C17H18N4O2S.C15H19N5OS/c1-9-4-5-12(6-14(9)20)26-13-7-24(8-13)19(25)17-16(21)15-10(2)11(3)22-23-18(15)27-17;1-11-12(2)21-22-18-15(11)16(20)17(25-18)19(24)23-9-8-14(10-23)13-6-4-3-5-7-13;1-10-11(2)20-21-17-14(10)15(19)16(26-17)18(23)22-8-13(9-22)27(24,25)12-6-4-3-5-7-12;1-8-9(2)22-23-17-13(8)14(19)15(26-17)16(24)21-7-11-4-5-12(20-6-11)25-10(3)18;1-8-6-11(4-5-12(8)22)7-19-16(23)15-14(18)13-9(2)10(3)20-21-17(13)24-15;1-7(2)17-10-5-20(6-10)15(21)13-12(16)11-8(3)9(4)18-19-14(11)22-13/h4-6,13H,7-8,21H2,1-3H3;3-7,14H,8-10,20H2,1-2H3;3-7,13H,8-9,19H2,1-2H3;4-6,10H,7,19H2,1-3H3,(H,21,24);4-6,22H,7,18H2,1-3H3,(H,19,23);10,17H,1,5-6,16H2,2-4H3
• InChIKey: UATXVEUBNOLPFK-UHFFFAOYSA-N
• XLogP: 17.25
• TPSA: 538.76 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 37
• Rotatable Bonds: 19
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2192.75
LogP ≤ 5	17.25
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 161040192) is (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is C=C(C)NC1CN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)ccc1O.Cc1ccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1F.Cc1nnc2sc(C(=O)N3CC(S(=O)(=O)c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(OC(C)F)nc3)c(N)c2c1C.

What is the InChIKey of (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is UATXVEUBNOLPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4OS2.C19H20N4OS.C18H18N4O3S2.C17H18FN5O2S.C17H18N4O2S.C15H19N5OS/c1-9-4-5-12(6-14(9)20)26-13-7-24(8-13)19(25)17-16(21)15-10(2)11(3)22-23-18(15)27-17;1-11-12(2)21-22-18-15(11)16(20)17(25-18)19(24)23-9-8-14(10-23)13-6-4-3-5-7-13;1-10-11(2)20-21-17-14(10)15(19)16(26-17)18(23)22-8-13(9-22)27(24,25)12-6-4-3-5-7-12;1-8-9(2)22-23-17-13(8)14(19)15(26-17)16(24)21-7-11-4-5-12(20-6-11)25-10(3)18;1-8-6-11(4-5-12(8)22)7-19-16(23)15-14(18)13-9(2)10(3)20-21-17(13)24-15;1-7(2)17-10-5-20(6-10)15(21)13-12(16)11-8(3)9(4)18-19-14(11)22-13/h4-6,13H,7-8,21H2,1-3H3;3-7,14H,8-10,20H2,1-2H3;3-7,13H,8-9,19H2,1-2H3;4-6,10H,7,19H2,1-3H3,(H,21,24);4-6,22H,7,18H2,1-3H3,(H,19,23);10,17H,1,5-6,16H2,2-4H3.

What are the key properties of (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

(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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2192.75 g/mol, XLogP of 17.25, 19 rotatable bonds, 10 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for (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-(3-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(prop-1-en-2-ylamino)azetidin-1-yl]methanone;5-amino-N-[[6-(1-fluoroethoxy)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-hydroxy-3-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 161040192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).