6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide

C59H58Cl2N28O10S4 — CID 159103399

IUPAC6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide
SMILESCOc1ccc(N)nn1.COc1ccc(Nc2cc(Nc3ncccc3S(C)(=O)=O)c(C(N)=O)nn2)nn1.COc1ccc(Nc2cc(Nc3ncccc3SC)c(C(N)=O)nn2)nn1.CSc1cccnc1Nc1cc(Cl)nnc1C(=O)O.CSc1cccnc1Nc1cc(Cl)nnc1C(N)=O
InChIInChI=1S/C16H16N8O4S.C16H16N8O2S.C11H10ClN5OS.C11H9ClN4O2S.C5H7N3O/c1-28-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(29(2,26)27)4-3-7-18-16;1-26-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(27-2)4-3-7-18-16;1-19-7-3-2-4-14-11(7)15-6-5-8(12)16-17-9(6)10(13)18;1-19-7-3-2-4-13-10(7)14-6-5-8(12)15-16-9(6)11(17)18;1-9-5-3-2-4(6)7-8-5/h3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);2-5H,1H3,(H2,13,18)(H,14,15,16);2-5H,1H3,(H,17,18)(H,13,14,15);2-3H,1H3,(H2,6,7)
InChIKeyKDOMSCGMCLJLSW-UHFFFAOYSA-N
MW1518.47 g/mol
LogP7.48
Rot. Bonds23

About 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide

6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide (PubChem CID 159103399) has the molecular formula C59H58Cl2N28O10S4 and a molecular weight of 1518.47 g/mol. Its IUPAC name is 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide
PubChem CID159103399
Molecular FormulaC59H58Cl2N28O10S4
Molecular Weight1518.47 g/mol
Exact Mass1516.32
IUPAC Name6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide
SMILESCOc1ccc(N)nn1.COc1ccc(Nc2cc(Nc3ncccc3S(C)(=O)=O)c(C(N)=O)nn2)nn1.COc1ccc(Nc2cc(Nc3ncccc3SC)c(C(N)=O)nn2)nn1.CSc1cccnc1Nc1cc(Cl)nnc1C(=O)O.CSc1cccnc1Nc1cc(Cl)nnc1C(N)=O
InChIInChI=1S/C16H16N8O4S.C16H16N8O2S.C11H10ClN5OS.C11H9ClN4O2S.C5H7N3O/c1-28-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(29(2,26)27)4-3-7-18-16;1-26-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(27-2)4-3-7-18-16;1-19-7-3-2-4-14-11(7)15-6-5-8(12)16-17-9(6)10(13)18;1-19-7-3-2-4-13-10(7)14-6-5-8(12)15-16-9(6)11(17)18;1-9-5-3-2-4(6)7-8-5/h3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);2-5H,1H3,(H2,13,18)(H,14,15,16);2-5H,1H3,(H,17,18)(H,13,14,15);2-3H,1H3,(H2,6,7)
InChIKeyKDOMSCGMCLJLSW-UHFFFAOYSA-N
XLogP7.48
TPSA558.62 Ų
H-Bond Donors11
H-Bond Acceptors37
Rotatable Bonds23
Heavy Atoms103
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001518.47
LogP ≤ 57.48
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1037

Analyze 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide (CID 159103399) is 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide is COc1ccc(N)nn1.COc1ccc(Nc2cc(Nc3ncccc3S(C)(=O)=O)c(C(N)=O)nn2)nn1.COc1ccc(Nc2cc(Nc3ncccc3SC)c(C(N)=O)nn2)nn1.CSc1cccnc1Nc1cc(Cl)nnc1C(=O)O.CSc1cccnc1Nc1cc(Cl)nnc1C(N)=O.
What is the InChIKey of 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide?
The InChIKey is KDOMSCGMCLJLSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N8O4S.C16H16N8O2S.C11H10ClN5OS.C11H9ClN4O2S.C5H7N3O/c1-28-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(29(2,26)27)4-3-7-18-16;1-26-13-6-5-11(21-23-13)20-12-8-9(14(15(17)25)24-22-12)19-16-10(27-2)4-3-7-18-16;1-19-7-3-2-4-14-11(7)15-6-5-8(12)16-17-9(6)10(13)18;1-19-7-3-2-4-13-10(7)14-6-5-8(12)15-16-9(6)11(17)18;1-9-5-3-2-4(6)7-8-5/h3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);3-8H,1-2H3,(H2,17,25)(H2,18,19,20,21,22);2-5H,1H3,(H2,13,18)(H,14,15,16);2-5H,1H3,(H,17,18)(H,13,14,15);2-3H,1H3,(H2,6,7).
What are the key properties of 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide?
6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide has a molecular weight of 1518.47 g/mol, XLogP of 7.48, 23 rotatable bonds, 11 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-chloro-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxylic acid;6-methoxypyridazin-3-amine;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfanyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-[(6-methoxypyridazin-3-yl)amino]-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 159103399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).