1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid

C123H133Cl5F8N20O10S3 — CID 167623149

IUPAC1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid
SMILESCC1CC(Cc2cccc(Nc3nccs3)n2)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC(C)=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(Nc3ncc(C)s3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.Cc1cnc(Nc2cccc(CC3(C(=O)O)CCN(Cc4cccc(Cl)c4F)C(C)C3)n2)s1
InChIInChI=1S/C26H29ClF2N4O2.C25H27ClF2N4O2S.C25H27ClF2N4O2.C24H26ClFN4O2S.C23H24ClFN4O2S/c1-3-18-12-26(25(34)35,9-10-33(18)15-17-5-4-6-19(27)24(17)29)13-21-20(28)7-8-22(31-21)32-23-11-16(2)14-30-23;1-3-17-11-25(23(33)34,9-10-32(17)14-16-5-4-6-18(26)22(16)28)12-20-19(27)7-8-21(30-20)31-24-29-13-15(2)35-24;1-2-17-13-25(24(33)34,10-12-32(17)15-16-5-3-6-18(26)23(16)28)14-20-19(27)8-9-22(30-20)31-21-7-4-11-29-21;1-15-11-24(22(31)32,9-10-30(15)14-17-5-3-7-19(25)21(17)26)12-18-6-4-8-20(28-18)29-23-27-13-16(2)33-23;1-15-12-23(21(30)31,8-10-29(15)14-16-4-2-6-18(24)20(16)25)13-17-5-3-7-19(27-17)28-22-26-9-11-32-22/h4-8,11,18H,3,9-10,12-15H2,1-2H3,(H,34,35)(H,30,31,32);4-8,13,17H,3,9-12,14H2,1-2H3,(H,33,34)(H,29,30,31);3-9,17H,2,10-15H2,1H3,(H,33,34)(H,29,30,31);3-8,13,15H,9-12,14H2,1-2H3,(H,31,32)(H,27,28,29);2-7,9,11,15H,8,10,12-14H2,1H3,(H,30,31)(H,26,27,28)
InChIKeyMSJLUGGAJOGAGF-UHFFFAOYSA-N
MW2477.00 g/mol
LogP27.82
Rot. Bonds36

About 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid

1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid (PubChem CID 167623149) has the molecular formula C123H133Cl5F8N20O10S3 and a molecular weight of 2477.00 g/mol. Its IUPAC name is 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid
PubChem CID167623149
Molecular FormulaC123H133Cl5F8N20O10S3
Molecular Weight2477.00 g/mol
Exact Mass2472.80
IUPAC Name1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid
SMILESCC1CC(Cc2cccc(Nc3nccs3)n2)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC(C)=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(Nc3ncc(C)s3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.Cc1cnc(Nc2cccc(CC3(C(=O)O)CCN(Cc4cccc(Cl)c4F)C(C)C3)n2)s1
InChIInChI=1S/C26H29ClF2N4O2.C25H27ClF2N4O2S.C25H27ClF2N4O2.C24H26ClFN4O2S.C23H24ClFN4O2S/c1-3-18-12-26(25(34)35,9-10-33(18)15-17-5-4-6-19(27)24(17)29)13-21-20(28)7-8-22(31-21)32-23-11-16(2)14-30-23;1-3-17-11-25(23(33)34,9-10-32(17)14-16-5-4-6-18(26)22(16)28)12-20-19(27)7-8-21(30-20)31-24-29-13-15(2)35-24;1-2-17-13-25(24(33)34,10-12-32(17)15-16-5-3-6-18(26)23(16)28)14-20-19(27)8-9-22(30-20)31-21-7-4-11-29-21;1-15-11-24(22(31)32,9-10-30(15)14-17-5-3-7-19(25)21(17)26)12-18-6-4-8-20(28-18)29-23-27-13-16(2)33-23;1-15-12-23(21(30)31,8-10-29(15)14-16-4-2-6-18(24)20(16)25)13-17-5-3-7-19(27-17)28-22-26-9-11-32-22/h4-8,11,18H,3,9-10,12-15H2,1-2H3,(H,34,35)(H,30,31,32);4-8,13,17H,3,9-12,14H2,1-2H3,(H,33,34)(H,29,30,31);3-9,17H,2,10-15H2,1H3,(H,33,34)(H,29,30,31);3-8,13,15H,9-12,14H2,1-2H3,(H,31,32)(H,27,28,29);2-7,9,11,15H,8,10,12-14H2,1H3,(H,30,31)(H,26,27,28)
InChIKeyMSJLUGGAJOGAGF-UHFFFAOYSA-N
XLogP27.82
TPSA390.69 Ų
H-Bond Donors10
H-Bond Acceptors28
Rotatable Bonds36
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002477.00
LogP ≤ 527.82
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1028

Analyze 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid?
The IUPAC name of 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid (CID 167623149) is 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid.
What is the SMILES notation for 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid?
The canonical SMILES for 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid is CC1CC(Cc2cccc(Nc3nccs3)n2)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC(C)=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(NC3=NCC=C3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.CCC1CC(Cc2nc(Nc3ncc(C)s3)ccc2F)(C(=O)O)CCN1Cc1cccc(Cl)c1F.Cc1cnc(Nc2cccc(CC3(C(=O)O)CCN(Cc4cccc(Cl)c4F)C(C)C3)n2)s1.
What is the InChIKey of 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid?
The InChIKey is MSJLUGGAJOGAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29ClF2N4O2.C25H27ClF2N4O2S.C25H27ClF2N4O2.C24H26ClFN4O2S.C23H24ClFN4O2S/c1-3-18-12-26(25(34)35,9-10-33(18)15-17-5-4-6-19(27)24(17)29)13-21-20(28)7-8-22(31-21)32-23-11-16(2)14-30-23;1-3-17-11-25(23(33)34,9-10-32(17)14-16-5-4-6-18(26)22(16)28)12-20-19(27)7-8-21(30-20)31-24-29-13-15(2)35-24;1-2-17-13-25(24(33)34,10-12-32(17)15-16-5-3-6-18(26)23(16)28)14-20-19(27)8-9-22(30-20)31-21-7-4-11-29-21;1-15-11-24(22(31)32,9-10-30(15)14-17-5-3-7-19(25)21(17)26)12-18-6-4-8-20(28-18)29-23-27-13-16(2)33-23;1-15-12-23(21(30)31,8-10-29(15)14-16-4-2-6-18(24)20(16)25)13-17-5-3-7-19(27-17)28-22-26-9-11-32-22/h4-8,11,18H,3,9-10,12-15H2,1-2H3,(H,34,35)(H,30,31,32);4-8,13,17H,3,9-12,14H2,1-2H3,(H,33,34)(H,29,30,31);3-9,17H,2,10-15H2,1H3,(H,33,34)(H,29,30,31);3-8,13,15H,9-12,14H2,1-2H3,(H,31,32)(H,27,28,29);2-7,9,11,15H,8,10,12-14H2,1H3,(H,30,31)(H,26,27,28).
What are the key properties of 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid?
1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid has a molecular weight of 2477.00 g/mol, XLogP of 27.82, 36 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(3-methyl-2H-pyrrol-5-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-ethyl-4-[[3-fluoro-6-(2H-pyrrol-5-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methyl]piperidine-4-carboxylic acid;1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-[[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]methyl]piperidine-4-carboxylic acid is sourced from PubChem (CID 167623149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).