2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane

C73H71Cl6N11O10S2 — CID 163570492

About 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane

2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane (PubChem CID 163570492) has the molecular formula C73H71Cl6N11O10S2 and a molecular weight of 1539.29 g/mol. Its IUPAC name is 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane.

Molecular Properties

• Compound Name: 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane
• PubChem CID: 163570492
• Molecular Formula: C73H71Cl6N11O10S2
• Molecular Weight: 1539.29 g/mol
• Exact Mass: 1535.30
• IUPAC Name: 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane
• SMILES: CC(=O)c1nc2c(C(C)C)c(C(=O)N[C@H]3CCOc4ccccc43)cnn2c1-c1cc(Cl)cc(Cl)c1.CC(=O)c1nc2c(C(C)C)c(C(=O)O)cnn2c1-c1cc(Cl)cc(Cl)c1.COC(=O)c1cnn2c(-c3cc(Cl)cc(Cl)c3)c(C(C)=O)nc2c1C(C)C.N[C@H]1CCOc2ccccc21.S.S
• InChI: InChI=1S/C27H24Cl2N4O3.C19H17Cl2N3O3.C18H15Cl2N3O3.C9H11NO.2H2S/c1-14(2)23-20(27(35)31-21-8-9-36-22-7-5-4-6-19(21)22)13-30-33-25(24(15(3)34)32-26(23)33)16-10-17(28)12-18(29)11-16;1-9(2)15-14(19(26)27-4)8-22-24-17(16(10(3)25)23-18(15)24)11-5-12(20)7-13(21)6-11;1-8(2)14-13(18(25)26)7-21-23-16(15(9(3)24)22-17(14)23)10-4-11(19)6-12(20)5-10;10-8-5-6-11-9-4-2-1-3-7(8)9;;/h4-7,10-14,21H,8-9H2,1-3H3,(H,31,35);5-9H,1-4H3;4-8H,1-3H3,(H,25,26);1-4,8H,5-6,10H2;2*1H2/t21-;;;8-;;/m0..0../s1
• InChIKey: FYXNCPZJVGMNBJ-VSCOQWIJSA-N
• XLogP: 17.52
• TPSA: 278.96 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 19
• Rotatable Bonds: 13
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1539.29
LogP ≤ 5	17.52
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane?

The IUPAC name of 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane (CID 163570492) is 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane.

What is the SMILES notation for 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane?

The canonical SMILES for 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane is CC(=O)c1nc2c(C(C)C)c(C(=O)N[C@H]3CCOc4ccccc43)cnn2c1-c1cc(Cl)cc(Cl)c1.CC(=O)c1nc2c(C(C)C)c(C(=O)O)cnn2c1-c1cc(Cl)cc(Cl)c1.COC(=O)c1cnn2c(-c3cc(Cl)cc(Cl)c3)c(C(C)=O)nc2c1C(C)C.N[C@H]1CCOc2ccccc21.S.S.

What is the InChIKey of 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane?

The InChIKey is FYXNCPZJVGMNBJ-VSCOQWIJSA-N. The full InChI is InChI=1S/C27H24Cl2N4O3.C19H17Cl2N3O3.C18H15Cl2N3O3.C9H11NO.2H2S/c1-14(2)23-20(27(35)31-21-8-9-36-22-7-5-4-6-19(21)22)13-30-33-25(24(15(3)34)32-26(23)33)16-10-17(28)12-18(29)11-16;1-9(2)15-14(19(26)27-4)8-22-24-17(16(10(3)25)23-18(15)24)11-5-12(20)7-13(21)6-11;1-8(2)14-13(18(25)26)7-21-23-16(15(9(3)24)22-17(14)23)10-4-11(19)6-12(20)5-10;10-8-5-6-11-9-4-2-1-3-7(8)9;;/h4-7,10-14,21H,8-9H2,1-3H3,(H,31,35);5-9H,1-4H3;4-8H,1-3H3,(H,25,26);1-4,8H,5-6,10H2;2*1H2/t21-;;;8-;;/m0..0../s1.

What are the key properties of 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane?

2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane has a molecular weight of 1539.29 g/mol, XLogP of 17.52, 13 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 2-acetyl-3-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxamide;2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylic acid;(4S)-3,4-dihydro-2H-chromen-4-amine;methyl 2-acetyl-3-(3,5-dichlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-7-carboxylate;sulfane is sourced from PubChem (CID 163570492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).