2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one

C125H85Cl6F9N40O5 — CID 167676809

IUPAC2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
SMILESCc1ccc(-c2cnc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2cnc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]c2F)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2Cl)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2F)c(F)n1
InChIInChI=1S/C25H17Cl2FN8O.C25H16ClF3N8O.2C25H17ClF2N8O.C25H18ClFN8O/c1-11-2-4-14(24(28)30-11)21-23(27)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-10-2-3-12(23(28)31-10)21-24(29)33-25(32-21)22-14-8-13(14)17-6-11(7-18(38)37(17)22)19-16(36-9-30-34-35-36)5-4-15(26)20(19)27;1-11-2-4-14(23(27)30-11)21-24(28)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-11-2-3-13(24(28)31-11)17-9-29-25(32-17)23-15-8-14(15)19-6-12(7-20(37)36(19)23)21-18(35-10-30-33-34-35)5-4-16(26)22(21)27;1-12-2-4-15(24(27)30-12)19-10-28-25(31-19)23-18-9-17(18)21-6-13(7-22(36)35(21)23)16-8-14(26)3-5-20(16)34-11-29-32-33-34/h2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9,13-14,22H,8H2,1H3,(H,32,33);2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9-10,14-15,23H,8H2,1H3,(H,29,32);2-8,10-11,17-18,23H,9H2,1H3,(H,28,31)
InChIKeyUYAOLNUPSUTGFT-UHFFFAOYSA-N
MW2611.03 g/mol
LogP21.63
Rot. Bonds20

About 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one

2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one (PubChem CID 167676809) has the molecular formula C125H85Cl6F9N40O5 and a molecular weight of 2611.03 g/mol. Its IUPAC name is 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one.

Molecular Properties

Compound Name2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
PubChem CID167676809
Molecular FormulaC125H85Cl6F9N40O5
Molecular Weight2611.03 g/mol
Exact Mass2606.56
IUPAC Name2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
SMILESCc1ccc(-c2cnc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2cnc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]c2F)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2Cl)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2F)c(F)n1
InChIInChI=1S/C25H17Cl2FN8O.C25H16ClF3N8O.2C25H17ClF2N8O.C25H18ClFN8O/c1-11-2-4-14(24(28)30-11)21-23(27)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-10-2-3-12(23(28)31-10)21-24(29)33-25(32-21)22-14-8-13(14)17-6-11(7-18(38)37(17)22)19-16(36-9-30-34-35-36)5-4-15(26)20(19)27;1-11-2-4-14(23(27)30-11)21-24(28)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-11-2-3-13(24(28)31-11)17-9-29-25(32-17)23-15-8-14(15)19-6-12(7-20(37)36(19)23)21-18(35-10-30-33-34-35)5-4-16(26)22(21)27;1-12-2-4-15(24(27)30-12)19-10-28-25(31-19)23-18-9-17(18)21-6-13(7-22(36)35(21)23)16-8-14(26)3-5-20(16)34-11-29-32-33-34/h2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9,13-14,22H,8H2,1H3,(H,32,33);2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9-10,14-15,23H,8H2,1H3,(H,29,32);2-8,10-11,17-18,23H,9H2,1H3,(H,28,31)
InChIKeyUYAOLNUPSUTGFT-UHFFFAOYSA-N
XLogP21.63
TPSA535.85 Ų
H-Bond Donors5
H-Bond Acceptors40
Rotatable Bonds20
Heavy Atoms185
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002611.03
LogP ≤ 521.63
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The IUPAC name of 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one (CID 167676809) is 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one.
What is the SMILES notation for 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The canonical SMILES for 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one is Cc1ccc(-c2cnc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2cnc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]2)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)cc(=O)n43)[nH]c2F)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2Cl)c(F)n1.Cc1ccc(-c2nc(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)[nH]c2F)c(F)n1.
What is the InChIKey of 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The InChIKey is UYAOLNUPSUTGFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17Cl2FN8O.C25H16ClF3N8O.2C25H17ClF2N8O.C25H18ClFN8O/c1-11-2-4-14(24(28)30-11)21-23(27)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-10-2-3-12(23(28)31-10)21-24(29)33-25(32-21)22-14-8-13(14)17-6-11(7-18(38)37(17)22)19-16(36-9-30-34-35-36)5-4-15(26)20(19)27;1-11-2-4-14(23(27)30-11)21-24(28)32-25(31-21)22-17-9-16(17)19-6-12(7-20(37)36(19)22)15-8-13(26)3-5-18(15)35-10-29-33-34-35;1-11-2-3-13(24(28)31-11)17-9-29-25(32-17)23-15-8-14(15)19-6-12(7-20(37)36(19)23)21-18(35-10-30-33-34-35)5-4-16(26)22(21)27;1-12-2-4-15(24(27)30-12)19-10-28-25(31-19)23-18-9-17(18)21-6-13(7-22(36)35(21)23)16-8-14(26)3-5-20(16)34-11-29-32-33-34/h2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9,13-14,22H,8H2,1H3,(H,32,33);2-8,10,16-17,22H,9H2,1H3,(H,31,32);2-7,9-10,14-15,23H,8H2,1H3,(H,29,32);2-8,10-11,17-18,23H,9H2,1H3,(H,28,31).
What are the key properties of 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one has a molecular weight of 2611.03 g/mol, XLogP of 21.63, 20 rotatable bonds, 5 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-chloro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-(2-fluoro-6-methyl-3-pyridinyl)-1H-imidazol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one is sourced from PubChem (CID 167676809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).