2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one

C143H104Cl8F3N29O6 — CID 167579202

IUPAC2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
SMILESC=C1C=C(O)c2cc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)ccc2C1.Cc1[nH]nc2ccc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)cc12.Cc1ccc(C2=C(Cl)C=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)cc1.Cc1ccc(C2=NC(F)=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1.Cc1ccc(C2=NC=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1
InChIInChI=1S/C32H23Cl2N5O2.C29H21Cl2N7O.C28H21Cl2N5O.C27H19ClF2N6O.C27H20ClFN6O/c1-16-6-17-2-3-18(8-24(17)30(40)7-16)22-9-20(10-27(22)34)32-26-14-25(26)29-11-19(12-31(41)39(29)32)23-13-21(33)4-5-28(23)38-15-35-36-37-38;1-14-19-6-15(2-4-25(19)34-33-14)20-7-17(8-24(20)31)29-23-12-22(23)27-9-16(10-28(39)38(27)29)21-11-18(30)3-5-26(21)37-13-32-35-36-37;1-15-2-4-16(5-3-15)20-8-18(9-24(20)30)28-23-13-22(23)26-10-17(11-27(36)35(26)28)21-12-19(29)6-7-25(21)34-14-31-32-33-34;1-13-2-4-16(21(29)6-13)22-11-20(27(30)32-22)26-19-10-18(19)24-7-14(8-25(37)36(24)26)17-9-15(28)3-5-23(17)35-12-31-33-34-35;1-14-2-4-18(22(29)6-14)23-7-16(12-30-23)27-21-11-20(21)25-8-15(9-26(36)35(25)27)19-10-17(28)3-5-24(19)34-13-31-32-33-34/h2-5,7-8,10-13,15,25-26,32,40H,1,6,9,14H2;2-6,8-11,13,22-23,29H,7,12H2,1H3,(H,33,34);2-7,9-12,14,22-23,28H,8,13H2,1H3;2-9,12,18-19,26H,10-11H2,1H3;2-6,8-10,12-13,20-21,27H,7,11H2,1H3
InChIKeyGYHRBSLKBZZDSC-UHFFFAOYSA-N
MW2665.22 g/mol
LogP29.20
Rot. Bonds20

About 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one

2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one (PubChem CID 167579202) has the molecular formula C143H104Cl8F3N29O6 and a molecular weight of 2665.22 g/mol. Its IUPAC name is 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one.

Molecular Properties

Compound Name2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
PubChem CID167579202
Molecular FormulaC143H104Cl8F3N29O6
Molecular Weight2665.22 g/mol
Exact Mass2659.62
IUPAC Name2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one
SMILESC=C1C=C(O)c2cc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)ccc2C1.Cc1[nH]nc2ccc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)cc12.Cc1ccc(C2=C(Cl)C=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)cc1.Cc1ccc(C2=NC(F)=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1.Cc1ccc(C2=NC=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1
InChIInChI=1S/C32H23Cl2N5O2.C29H21Cl2N7O.C28H21Cl2N5O.C27H19ClF2N6O.C27H20ClFN6O/c1-16-6-17-2-3-18(8-24(17)30(40)7-16)22-9-20(10-27(22)34)32-26-14-25(26)29-11-19(12-31(41)39(29)32)23-13-21(33)4-5-28(23)38-15-35-36-37-38;1-14-19-6-15(2-4-25(19)34-33-14)20-7-17(8-24(20)31)29-23-12-22(23)27-9-16(10-28(39)38(27)29)21-11-18(30)3-5-26(21)37-13-32-35-36-37;1-15-2-4-16(5-3-15)20-8-18(9-24(20)30)28-23-13-22(23)26-10-17(11-27(36)35(26)28)21-12-19(29)6-7-25(21)34-14-31-32-33-34;1-13-2-4-16(21(29)6-13)22-11-20(27(30)32-22)26-19-10-18(19)24-7-14(8-25(37)36(24)26)17-9-15(28)3-5-23(17)35-12-31-33-34-35;1-14-2-4-18(22(29)6-14)23-7-16(12-30-23)27-21-11-20(21)25-8-15(9-26(36)35(25)27)19-10-17(28)3-5-24(19)34-13-31-32-33-34/h2-5,7-8,10-13,15,25-26,32,40H,1,6,9,14H2;2-6,8-11,13,22-23,29H,7,12H2,1H3,(H,33,34);2-7,9-12,14,22-23,28H,8,13H2,1H3;2-9,12,18-19,26H,10-11H2,1H3;2-6,8-10,12-13,20-21,27H,7,11H2,1H3
InChIKeyGYHRBSLKBZZDSC-UHFFFAOYSA-N
XLogP29.20
TPSA401.63 Ų
H-Bond Donors2
H-Bond Acceptors34
Rotatable Bonds20
Heavy Atoms189
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002665.22
LogP ≤ 529.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-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-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The IUPAC name of 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one (CID 167579202) is 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one.
What is the SMILES notation for 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The canonical SMILES for 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one is C=C1C=C(O)c2cc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)ccc2C1.Cc1[nH]nc2ccc(C3=C(Cl)C=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)cc12.Cc1ccc(C2=C(Cl)C=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)cc1.Cc1ccc(C2=NC(F)=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1.Cc1ccc(C2=NC=C(C3C4CC4c4cc(-c5cc(Cl)ccc5-n5cnnn5)cc(=O)n43)C2)c(F)c1.
What is the InChIKey of 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
The InChIKey is GYHRBSLKBZZDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23Cl2N5O2.C29H21Cl2N7O.C28H21Cl2N5O.C27H19ClF2N6O.C27H20ClFN6O/c1-16-6-17-2-3-18(8-24(17)30(40)7-16)22-9-20(10-27(22)34)32-26-14-25(26)29-11-19(12-31(41)39(29)32)23-13-21(33)4-5-28(23)38-15-35-36-37-38;1-14-19-6-15(2-4-25(19)34-33-14)20-7-17(8-24(20)31)29-23-12-22(23)27-9-16(10-28(39)38(27)29)21-11-18(30)3-5-26(21)37-13-32-35-36-37;1-15-2-4-16(5-3-15)20-8-18(9-24(20)30)28-23-13-22(23)26-10-17(11-27(36)35(26)28)21-12-19(29)6-7-25(21)34-14-31-32-33-34;1-13-2-4-16(21(29)6-13)22-11-20(27(30)32-22)26-19-10-18(19)24-7-14(8-25(37)36(24)26)17-9-15(28)3-5-23(17)35-12-31-33-34-35;1-14-2-4-18(22(29)6-14)23-7-16(12-30-23)27-21-11-20(21)25-8-15(9-26(36)35(25)27)19-10-17(28)3-5-24(19)34-13-31-32-33-34/h2-5,7-8,10-13,15,25-26,32,40H,1,6,9,14H2;2-6,8-11,13,22-23,29H,7,12H2,1H3,(H,33,34);2-7,9-12,14,22-23,28H,8,13H2,1H3;2-9,12,18-19,26H,10-11H2,1H3;2-6,8-10,12-13,20-21,27H,7,11H2,1H3.
What are the key properties of 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one?
2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one has a molecular weight of 2665.22 g/mol, XLogP of 29.20, 20 rotatable bonds, 2 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-4-(8-hydroxy-6-methylidene-5H-naphthalen-2-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(3-methyl-2H-indazol-5-yl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;2-[3-chloro-4-(4-methylphenyl)cyclopenta-1,3-dien-1-yl]-6-[5-chloro-2-(tetrazol-1-yl)phenyl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[5-fluoro-2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one;6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[2-(2-fluoro-4-methylphenyl)-3H-pyrrol-4-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one is sourced from PubChem (CID 167579202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).