4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole

C130H133Cl2F11IN25O6 — CID 157153507

IUPAC4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole
SMILESCc1noc(C)c1-c1cnc2c(-c3cnn(C(F)F)c3)cn(CC3CC(C)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(CC(C)(F)F)c3)cn(CC3CC(F)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(Cc4ccccc4)c3)cn(CC3CCC(F)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(C(CC#N)C3CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(CC3CCC(C)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(I)cn(CC3CC(C)(F)C3)c2c1
InChIInChI=1S/C29H29F2N5O.C23H23F4N5O.C22H22F3N5O.C20H23ClFN3O.C18H17ClN4O.C18H19FIN3O/c1-19-27(20(2)37-34-19)23-12-26-28(32-13-23)25(18-35(26)15-22-8-10-29(30,31)11-9-22)24-14-33-36(17-24)16-21-6-4-3-5-7-21;1-13-20(14(2)33-30-13)16-4-19-21(28-7-16)18(11-31(19)9-15-5-23(26,27)6-15)17-8-29-32(10-17)12-22(3,24)25;1-12-19(13(2)31-28-12)15-4-18-20(26-7-15)17(16-8-27-30(10-16)21(23)24)11-29(18)9-14-5-22(3,25)6-14;1-12-18(13(2)26-24-12)15-8-17-19(23-9-15)16(21)11-25(17)10-14-4-6-20(3,22)7-5-14;1-10-17(11(2)24-22-10)13-7-16-18(21-8-13)14(19)9-23(16)15(5-6-20)12-3-4-12;1-10-16(11(2)24-22-10)13-4-15-17(21-7-13)14(20)9-23(15)8-12-5-18(3,19)6-12/h3-7,12-14,17-18,22H,8-11,15-16H2,1-2H3;4,7-8,10-11,15H,5-6,9,12H2,1-3H3;4,7-8,10-11,14,21H,5-6,9H2,1-3H3;8-9,11,14H,4-7,10H2,1-3H3;7-9,12,15H,3-5H2,1-2H3;4,7,9,12H,5-6,8H2,1-3H3
InChIKeyALNPEZWIMLFKKQ-UHFFFAOYSA-N
MW2548.45 g/mol
LogP34.38
Rot. Bonds27

About 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole

4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole (PubChem CID 157153507) has the molecular formula C130H133Cl2F11IN25O6 and a molecular weight of 2548.45 g/mol. Its IUPAC name is 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole.

Molecular Properties

Compound Name4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole
PubChem CID157153507
Molecular FormulaC130H133Cl2F11IN25O6
Molecular Weight2548.45 g/mol
Exact Mass2545.91
IUPAC Name4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole
SMILESCc1noc(C)c1-c1cnc2c(-c3cnn(C(F)F)c3)cn(CC3CC(C)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(CC(C)(F)F)c3)cn(CC3CC(F)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(Cc4ccccc4)c3)cn(CC3CCC(F)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(C(CC#N)C3CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(CC3CCC(C)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(I)cn(CC3CC(C)(F)C3)c2c1
InChIInChI=1S/C29H29F2N5O.C23H23F4N5O.C22H22F3N5O.C20H23ClFN3O.C18H17ClN4O.C18H19FIN3O/c1-19-27(20(2)37-34-19)23-12-26-28(32-13-23)25(18-35(26)15-22-8-10-29(30,31)11-9-22)24-14-33-36(17-24)16-21-6-4-3-5-7-21;1-13-20(14(2)33-30-13)16-4-19-21(28-7-16)18(11-31(19)9-15-5-23(26,27)6-15)17-8-29-32(10-17)12-22(3,24)25;1-12-19(13(2)31-28-12)15-4-18-20(26-7-15)17(16-8-27-30(10-16)21(23)24)11-29(18)9-14-5-22(3,25)6-14;1-12-18(13(2)26-24-12)15-8-17-19(23-9-15)16(21)11-25(17)10-14-4-6-20(3,22)7-5-14;1-10-17(11(2)24-22-10)13-7-16-18(21-8-13)14(19)9-23(16)15(5-6-20)12-3-4-12;1-10-16(11(2)24-22-10)13-4-15-17(21-7-13)14(20)9-23(15)8-12-5-18(3,19)6-12/h3-7,12-14,17-18,22H,8-11,15-16H2,1-2H3;4,7-8,10-11,15H,5-6,9,12H2,1-3H3;4,7-8,10-11,14,21H,5-6,9H2,1-3H3;8-9,11,14H,4-7,10H2,1-3H3;7-9,12,15H,3-5H2,1-2H3;4,7,9,12H,5-6,8H2,1-3H3
InChIKeyALNPEZWIMLFKKQ-UHFFFAOYSA-N
XLogP34.38
TPSA340.35 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds27
Heavy Atoms175
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002548.45
LogP ≤ 534.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole?
The IUPAC name of 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole (CID 157153507) is 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole.
What is the SMILES notation for 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole?
The canonical SMILES for 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole is Cc1noc(C)c1-c1cnc2c(-c3cnn(C(F)F)c3)cn(CC3CC(C)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(CC(C)(F)F)c3)cn(CC3CC(F)(F)C3)c2c1.Cc1noc(C)c1-c1cnc2c(-c3cnn(Cc4ccccc4)c3)cn(CC3CCC(F)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(C(CC#N)C3CC3)c2c1.Cc1noc(C)c1-c1cnc2c(Cl)cn(CC3CCC(C)(F)CC3)c2c1.Cc1noc(C)c1-c1cnc2c(I)cn(CC3CC(C)(F)C3)c2c1.
What is the InChIKey of 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole?
The InChIKey is ALNPEZWIMLFKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29F2N5O.C23H23F4N5O.C22H22F3N5O.C20H23ClFN3O.C18H17ClN4O.C18H19FIN3O/c1-19-27(20(2)37-34-19)23-12-26-28(32-13-23)25(18-35(26)15-22-8-10-29(30,31)11-9-22)24-14-33-36(17-24)16-21-6-4-3-5-7-21;1-13-20(14(2)33-30-13)16-4-19-21(28-7-16)18(11-31(19)9-15-5-23(26,27)6-15)17-8-29-32(10-17)12-22(3,24)25;1-12-19(13(2)31-28-12)15-4-18-20(26-7-15)17(16-8-27-30(10-16)21(23)24)11-29(18)9-14-5-22(3,25)6-14;1-12-18(13(2)26-24-12)15-8-17-19(23-9-15)16(21)11-25(17)10-14-4-6-20(3,22)7-5-14;1-10-17(11(2)24-22-10)13-7-16-18(21-8-13)14(19)9-23(16)15(5-6-20)12-3-4-12;1-10-16(11(2)24-22-10)13-4-15-17(21-7-13)14(20)9-23(15)8-12-5-18(3,19)6-12/h3-7,12-14,17-18,22H,8-11,15-16H2,1-2H3;4,7-8,10-11,15H,5-6,9,12H2,1-3H3;4,7-8,10-11,14,21H,5-6,9H2,1-3H3;8-9,11,14H,4-7,10H2,1-3H3;7-9,12,15H,3-5H2,1-2H3;4,7,9,12H,5-6,8H2,1-3H3.
What are the key properties of 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole?
4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole has a molecular weight of 2548.45 g/mol, XLogP of 34.38, 27 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-benzylpyrazol-4-yl)-1-[(4,4-difluorocyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;3-[3-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[3,2-b]pyridin-1-yl]-3-cyclopropylpropanenitrile;4-[3-chloro-1-[(4-fluoro-4-methylcyclohexyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3,3-difluorocyclobutyl)methyl]-3-[1-(2,2-difluoropropyl)pyrazol-4-yl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[3-[1-(difluoromethyl)pyrazol-4-yl]-1-[(3-fluoro-3-methylcyclobutyl)methyl]pyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole;4-[1-[(3-fluoro-3-methylcyclobutyl)methyl]-3-iodopyrrolo[3,2-b]pyridin-6-yl]-3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 157153507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).