benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid

C161H180Cl4N36O25S5 — CID 161169207

About benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid

benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid (PubChem CID 161169207) has the molecular formula C161H180Cl4N36O25S5 and a molecular weight of 3321.58 g/mol. Its IUPAC name is benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid.

Molecular Properties

• Compound Name: benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid
• PubChem CID: 161169207
• Molecular Formula: C161H180Cl4N36O25S5
• Molecular Weight: 3321.58 g/mol
• Exact Mass: 3317.13
• IUPAC Name: benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid
• SMILES: CN(C)C(=O)CN(c1ncnc2[nH]ccc12)[C@@H]1CCCN(C(=O)CNc2cc(Cl)cc(Cl)c2)C1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCN(C(=O)CNc5cc(Cl)cc(Cl)c5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCNC4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)O)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC=O)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1
• InChI: InChI=1S/C30H33Cl2N7O4S.C30H34N6O5S.C28H29N5O6S.C28H29N5O5S.C23H27Cl2N7O2.C22H28N6O3S/c1-20-6-8-25(9-7-20)44(42,43)39-12-10-26-29(34-19-35-30(26)39)38(18-28(41)36(2)3)24-5-4-11-37(17-24)27(40)16-33-23-14-21(31)13-22(32)15-23;1-22-11-13-25(14-12-22)42(39,40)36-17-15-26-28(31-21-32-29(26)36)35(19-27(37)33(2)3)24-10-7-16-34(18-24)30(38)41-20-23-8-5-4-6-9-23;1-20-9-11-23(12-10-20)40(37,38)33-15-13-24-26(29-19-30-27(24)33)32(17-25(34)35)22-8-5-14-31(16-22)28(36)39-18-21-6-3-2-4-7-21;1-21-9-11-24(12-10-21)39(36,37)33-15-13-25-26(29-20-30-27(25)33)32(16-17-34)23-8-5-14-31(18-23)28(35)38-19-22-6-3-2-4-7-22;1-30(2)21(34)13-32(23-19-5-6-26-22(19)28-14-29-23)18-4-3-7-31(12-18)20(33)11-27-17-9-15(24)8-16(25)10-17;1-16-6-8-18(9-7-16)32(30,31)28-12-10-19-21(24-15-25-22(19)28)27(14-20(29)26(2)3)17-5-4-11-23-13-17/h6-10,12-15,19,24,33H,4-5,11,16-18H2,1-3H3;4-6,8-9,11-15,17,21,24H,7,10,16,18-20H2,1-3H3;2-4,6-7,9-13,15,19,22H,5,8,14,16-18H2,1H3,(H,34,35);2-4,6-7,9-13,15,17,20,23H,5,8,14,16,18-19H2,1H3;5-6,8-10,14,18,27H,3-4,7,11-13H2,1-2H3,(H,26,28,29);6-10,12,15,17,23H,4-5,11,13-14H2,1-3H3/t2*24-;22-;23-;18-;17-/m111111/s1
• InChIKey: UQYMFDATZLSGGH-UIWFDKTJSA-N
• XLogP: 20.29
• TPSA: 686.20 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 50
• Rotatable Bonds: 46
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3321.58
LogP ≤ 5	20.29
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid?

The IUPAC name of benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid (CID 161169207) is benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid.

What is the SMILES notation for benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid?

The canonical SMILES for benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid is CN(C)C(=O)CN(c1ncnc2[nH]ccc12)[C@@H]1CCCN(C(=O)CNc2cc(Cl)cc(Cl)c2)C1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCN(C(=O)CNc5cc(Cl)cc(Cl)c5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)N(C)C)[C@@H]4CCCNC4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC(=O)O)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(N(CC=O)[C@@H]4CCCN(C(=O)OCc5ccccc5)C4)ncnc32)cc1.

What is the InChIKey of benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid?

The InChIKey is UQYMFDATZLSGGH-UIWFDKTJSA-N. The full InChI is InChI=1S/C30H33Cl2N7O4S.C30H34N6O5S.C28H29N5O6S.C28H29N5O5S.C23H27Cl2N7O2.C22H28N6O3S/c1-20-6-8-25(9-7-20)44(42,43)39-12-10-26-29(34-19-35-30(26)39)38(18-28(41)36(2)3)24-5-4-11-37(17-24)27(40)16-33-23-14-21(31)13-22(32)15-23;1-22-11-13-25(14-12-22)42(39,40)36-17-15-26-28(31-21-32-29(26)36)35(19-27(37)33(2)3)24-10-7-16-34(18-24)30(38)41-20-23-8-5-4-6-9-23;1-20-9-11-23(12-10-20)40(37,38)33-15-13-24-26(29-19-30-27(24)33)32(17-25(34)35)22-8-5-14-31(16-22)28(36)39-18-21-6-3-2-4-7-21;1-21-9-11-24(12-10-21)39(36,37)33-15-13-25-26(29-20-30-27(25)33)32(16-17-34)23-8-5-14-31(18-23)28(35)38-19-22-6-3-2-4-7-22;1-30(2)21(34)13-32(23-19-5-6-26-22(19)28-14-29-23)18-4-3-7-31(12-18)20(33)11-27-17-9-15(24)8-16(25)10-17;1-16-6-8-18(9-7-16)32(30,31)28-12-10-19-21(24-15-25-22(19)28)27(14-20(29)26(2)3)17-5-4-11-23-13-17/h6-10,12-15,19,24,33H,4-5,11,16-18H2,1-3H3;4-6,8-9,11-15,17,21,24H,7,10,16,18-20H2,1-3H3;2-4,6-7,9-13,15,19,22H,5,8,14,16-18H2,1H3,(H,34,35);2-4,6-7,9-13,15,17,20,23H,5,8,14,16,18-19H2,1H3;5-6,8-10,14,18,27H,3-4,7,11-13H2,1-2H3,(H,26,28,29);6-10,12,15,17,23H,4-5,11,13-14H2,1-3H3/t2*24-;22-;23-;18-;17-/m111111/s1.

What are the key properties of benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid?

benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid has a molecular weight of 3321.58 g/mol, XLogP of 20.29, 46 rotatable bonds, 5 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl (3R)-3-[[2-(dimethylamino)-2-oxoethyl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate;benzyl (3R)-3-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-(2-oxoethyl)amino]piperidine-1-carboxylate;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]amino]-N,N-dimethylacetamide;2-[[(3R)-1-[2-(3,5-dichloroanilino)acetyl]piperidin-3-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide;N,N-dimethyl-2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-piperidin-3-yl]amino]acetamide;2-[[7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidin-4-yl]-[(3R)-1-phenylmethoxycarbonylpiperidin-3-yl]amino]acetic acid is sourced from PubChem (CID 161169207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).