3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C109H113BBr2Cl3F6N29O12 — CID 167595362

IUPAC3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
SMILESCC(C)N1c2c(-c3ccn[nH]3)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(CC(=O)Cc3cnccn3)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(N)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(NC(=O)Nc3cnccn3)C21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.Nc1cnccn1.O=C(Nc1cnccn1)n1ccnc1.O=C(n1ccnc1)n1ccnc1
InChIInChI=1S/C32H31ClF2N6O3.C27H26BrClF2N6O3.C22H23BrClF2N3O2.C9H15BN2O2.C8H7N5O.C7H6N4O.C4H5N3/c1-18(2)41-29-19(13-23(42)16-22-17-36-11-12-37-22)3-8-25(29)26-14-20(15-27(30(26)41)28-9-10-38-40-28)31(43)39-21-4-6-24(7-5-21)44-32(33,34)35;1-14(2)37-23-19(18-7-8-21(24(18)37)35-26(39)36-22-13-32-9-10-33-22)11-15(12-20(23)28)25(38)34-16-3-5-17(6-4-16)40-27(29,30)31;1-11(2)29-19-16(15-7-8-18(27)20(15)29)9-12(10-17(19)23)21(30)28-13-3-5-14(6-4-13)31-22(24,25)26;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;14-8(13-4-3-10-6-13)12-7-5-9-1-2-11-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4-3-6-1-2-7-4/h4-7,9-12,14-15,17-19,25,29H,3,8,13,16H2,1-2H3,(H,38,40)(H,39,43);3-6,9-14,18,21,24H,7-8H2,1-2H3,(H,34,38)(H2,33,35,36,39);3-6,9-11,15,18,20H,7-8,27H2,1-2H3,(H,28,30);5-6H,1-4H3,(H,11,12);1-6H,(H,11,12,14);1-6H;1-3H,(H2,5,7)
InChIKeyIZLRQZLVFHJVEG-UHFFFAOYSA-N
MW2412.26 g/mol
LogP20.69
Rot. Bonds24

About 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (PubChem CID 167595362) has the molecular formula C109H113BBr2Cl3F6N29O12 and a molecular weight of 2412.26 g/mol. Its IUPAC name is 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole.

Molecular Properties

Compound Name3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
PubChem CID167595362
Molecular FormulaC109H113BBr2Cl3F6N29O12
Molecular Weight2412.26 g/mol
Exact Mass2407.66
IUPAC Name3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
SMILESCC(C)N1c2c(-c3ccn[nH]3)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(CC(=O)Cc3cnccn3)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(N)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(NC(=O)Nc3cnccn3)C21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.Nc1cnccn1.O=C(Nc1cnccn1)n1ccnc1.O=C(n1ccnc1)n1ccnc1
InChIInChI=1S/C32H31ClF2N6O3.C27H26BrClF2N6O3.C22H23BrClF2N3O2.C9H15BN2O2.C8H7N5O.C7H6N4O.C4H5N3/c1-18(2)41-29-19(13-23(42)16-22-17-36-11-12-37-22)3-8-25(29)26-14-20(15-27(30(26)41)28-9-10-38-40-28)31(43)39-21-4-6-24(7-5-21)44-32(33,34)35;1-14(2)37-23-19(18-7-8-21(24(18)37)35-26(39)36-22-13-32-9-10-33-22)11-15(12-20(23)28)25(38)34-16-3-5-17(6-4-16)40-27(29,30)31;1-11(2)29-19-16(15-7-8-18(27)20(15)29)9-12(10-17(19)23)21(30)28-13-3-5-14(6-4-13)31-22(24,25)26;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;14-8(13-4-3-10-6-13)12-7-5-9-1-2-11-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4-3-6-1-2-7-4/h4-7,9-12,14-15,17-19,25,29H,3,8,13,16H2,1-2H3,(H,38,40)(H,39,43);3-6,9-14,18,21,24H,7-8H2,1-2H3,(H,34,38)(H2,33,35,36,39);3-6,9-11,15,18,20H,7-8,27H2,1-2H3,(H,28,30);5-6H,1-4H3,(H,11,12);1-6H,(H,11,12,14);1-6H;1-3H,(H2,5,7)
InChIKeyIZLRQZLVFHJVEG-UHFFFAOYSA-N
XLogP20.69
TPSA513.52 Ų
H-Bond Donors10
H-Bond Acceptors33
Rotatable Bonds24
Heavy Atoms162
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002412.26
LogP ≤ 520.69
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole with MolForge

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Related Compounds

lithium;1-(3-amino-5-bromo-4-piperidin-1-ylphenyl)ethanone;9-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;9-bromo-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxylic acid;1-(9-bromo-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)ethanone;4-[chloro(difluoro)methoxy]aniline;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;deuterio(fluoro)methane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;hydroxide
CID 157776596
(4S)-6-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-(fluoromethyl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-6-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-(hydroxymethyl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4S)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-(fluoromethyl)-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
CID 159755105
7-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-[(2R)-1-fluoropropan-2-yl]benzimidazole-5-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-[(2R)-1-fluoropropan-2-yl]-7-[2-(oxan-2-yl)pyrazol-3-yl]benzimidazole-5-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-[(2R)-1-fluoropropan-2-yl]-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
CID 160116890
3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylamino)-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-fluoropyrazine;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
CID 167621381

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?
The IUPAC name of 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (CID 167595362) is 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole.
What is the SMILES notation for 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?
The canonical SMILES for 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is CC(C)N1c2c(-c3ccn[nH]3)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(CC(=O)Cc3cnccn3)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(N)C21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CCC(NC(=O)Nc3cnccn3)C21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.Nc1cnccn1.O=C(Nc1cnccn1)n1ccnc1.O=C(n1ccnc1)n1ccnc1.
What is the InChIKey of 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?
The InChIKey is IZLRQZLVFHJVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H31ClF2N6O3.C27H26BrClF2N6O3.C22H23BrClF2N3O2.C9H15BN2O2.C8H7N5O.C7H6N4O.C4H5N3/c1-18(2)41-29-19(13-23(42)16-22-17-36-11-12-37-22)3-8-25(29)26-14-20(15-27(30(26)41)28-9-10-38-40-28)31(43)39-21-4-6-24(7-5-21)44-32(33,34)35;1-14(2)37-23-19(18-7-8-21(24(18)37)35-26(39)36-22-13-32-9-10-33-22)11-15(12-20(23)28)25(38)34-16-3-5-17(6-4-16)40-27(29,30)31;1-11(2)29-19-16(15-7-8-18(27)20(15)29)9-12(10-17(19)23)21(30)28-13-3-5-14(6-4-13)31-22(24,25)26;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;14-8(13-4-3-10-6-13)12-7-5-9-1-2-11-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4-3-6-1-2-7-4/h4-7,9-12,14-15,17-19,25,29H,3,8,13,16H2,1-2H3,(H,38,40)(H,39,43);3-6,9-14,18,21,24H,7-8H2,1-2H3,(H,34,38)(H2,33,35,36,39);3-6,9-11,15,18,20H,7-8,27H2,1-2H3,(H,28,30);5-6H,1-4H3,(H,11,12);1-6H,(H,11,12,14);1-6H;1-3H,(H2,5,7).
What are the key properties of 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?
3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole has a molecular weight of 2412.26 g/mol, XLogP of 20.69, 24 rotatable bonds, 10 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-3-(pyrazin-2-ylcarbamoylamino)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-3-(2-oxo-3-pyrazin-2-ylpropyl)-4-propan-2-yl-5-(1H-pyrazol-5-yl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;di(imidazol-1-yl)methanone;pyrazin-2-amine;N-pyrazin-2-ylimidazole-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is sourced from PubChem (CID 167595362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).