4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide

C172H162F3N51O8S7 — CID 159249211

About 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide

4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 159249211) has the molecular formula C172H162F3N51O8S7 and a molecular weight of 3353.00 g/mol. Its IUPAC name is 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

• Compound Name: 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide
• PubChem CID: 159249211
• Molecular Formula: C172H162F3N51O8S7
• Molecular Weight: 3353.00 g/mol
• Exact Mass: 3350.18
• IUPAC Name: 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide
• SMILES: CC(C)NC(=O)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.N#Cc1ccc(NC(=O)N2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)cc1.O=C(NC1CCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NC1CCCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NCCCN1CCOCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(Nc1ccc(C(F)(F)F)cc1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(Nc1ccccc1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1
• InChI: InChI=1S/C26H20F3N7OS.C26H30N8O2S.C26H20N8OS.C25H21N7OS.C24H25N7OS.C23H23N7OS.C22H23N7OS/c27-26(28,29)16-1-3-17(4-2-16)34-25(37)36-9-7-15(8-10-36)21-12-19-23(30-13-31-24(19)35-21)33-18-5-6-20-22(11-18)38-14-32-20;35-26(27-6-1-7-33-10-12-36-13-11-33)34-8-4-18(5-9-34)22-15-20-24(28-16-29-25(20)32-22)31-19-2-3-21-23(14-19)37-17-30-21;27-13-16-1-3-18(4-2-16)32-26(35)34-9-7-17(8-10-34)22-12-20-24(28-14-29-25(20)33-22)31-19-5-6-21-23(11-19)36-15-30-21;33-25(30-17-4-2-1-3-5-17)32-10-8-16(9-11-32)21-13-19-23(26-14-27-24(19)31-21)29-18-6-7-20-22(12-18)34-15-28-20;32-24(29-16-3-1-2-4-16)31-9-7-15(8-10-31)20-12-18-22(25-13-26-23(18)30-20)28-17-5-6-19-21(11-17)33-14-27-19;31-23(28-15-2-1-3-15)30-8-6-14(7-9-30)19-11-17-21(24-12-25-22(17)29-19)27-16-4-5-18-20(10-16)32-13-26-18;1-13(2)26-22(30)29-7-5-14(6-8-29)18-10-16-20(23-11-24-21(16)28-18)27-15-3-4-17-19(9-15)31-12-25-17/h1-7,11-14H,8-10H2,(H,34,37)(H2,30,31,33,35);2-4,14-17H,1,5-13H2,(H,27,35)(H2,28,29,31,32);1-7,11-12,14-15H,8-10H2,(H,32,35)(H2,28,29,31,33);1-8,12-15H,9-11H2,(H,30,33)(H2,26,27,29,31);5-7,11-14,16H,1-4,8-10H2,(H,29,32)(H2,25,26,28,30);4-6,10-13,15H,1-3,7-9H2,(H,28,31)(H2,24,25,27,29);3-5,9-13H,6-8H2,1-2H3,(H,26,30)(H2,23,24,27,28)
• InChIKey: KVBOQPNZNRUKBE-UHFFFAOYSA-N
• XLogP: 35.85
• TPSA: 728.07 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 45
• Rotatable Bonds: 31
• Heavy Atoms: 241
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3353.00
LogP ≤ 5	35.85
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide?

The IUPAC name of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide (CID 159249211) is 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide.

What is the SMILES notation for 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide?

The canonical SMILES for 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide is CC(C)NC(=O)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.N#Cc1ccc(NC(=O)N2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)cc1.O=C(NC1CCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NC1CCCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NCCCN1CCOCC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(Nc1ccc(C(F)(F)F)cc1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(Nc1ccccc1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.

What is the InChIKey of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide?

The InChIKey is KVBOQPNZNRUKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20F3N7OS.C26H30N8O2S.C26H20N8OS.C25H21N7OS.C24H25N7OS.C23H23N7OS.C22H23N7OS/c27-26(28,29)16-1-3-17(4-2-16)34-25(37)36-9-7-15(8-10-36)21-12-19-23(30-13-31-24(19)35-21)33-18-5-6-20-22(11-18)38-14-32-20;35-26(27-6-1-7-33-10-12-36-13-11-33)34-8-4-18(5-9-34)22-15-20-24(28-16-29-25(20)32-22)31-19-2-3-21-23(14-19)37-17-30-21;27-13-16-1-3-18(4-2-16)32-26(35)34-9-7-17(8-10-34)22-12-20-24(28-14-29-25(20)33-22)31-19-5-6-21-23(11-19)36-15-30-21;33-25(30-17-4-2-1-3-5-17)32-10-8-16(9-11-32)21-13-19-23(26-14-27-24(19)31-21)29-18-6-7-20-22(12-18)34-15-28-20;32-24(29-16-3-1-2-4-16)31-9-7-15(8-10-31)20-12-18-22(25-13-26-23(18)30-20)28-17-5-6-19-21(11-17)33-14-27-19;31-23(28-15-2-1-3-15)30-8-6-14(7-9-30)19-11-17-21(24-12-25-22(17)29-19)27-16-4-5-18-20(10-16)32-13-26-18;1-13(2)26-22(30)29-7-5-14(6-8-29)18-10-16-20(23-11-24-21(16)28-18)27-15-3-4-17-19(9-15)31-12-25-17/h1-7,11-14H,8-10H2,(H,34,37)(H2,30,31,33,35);2-4,14-17H,1,5-13H2,(H,27,35)(H2,28,29,31,32);1-7,11-12,14-15H,8-10H2,(H,32,35)(H2,28,29,31,33);1-8,12-15H,9-11H2,(H,30,33)(H2,26,27,29,31);5-7,11-14,16H,1-4,8-10H2,(H,29,32)(H2,25,26,28,30);4-6,10-13,15H,1-3,7-9H2,(H,28,31)(H2,24,25,27,29);3-5,9-13H,6-8H2,1-2H3,(H,26,30)(H2,23,24,27,28).

What are the key properties of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide?

4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 3353.00 g/mol, XLogP of 35.85, 31 rotatable bonds, 21 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(4-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclobutyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-(3-morpholin-4-ylpropyl)-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-propan-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 159249211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).