4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine

C155H182F2N48O5S6 — CID 159111756

About 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine

4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine (PubChem CID 159111756) has the molecular formula C155H182F2N48O5S6 and a molecular weight of 3027.89 g/mol. Its IUPAC name is 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine.

Molecular Properties

• Compound Name: 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine
• PubChem CID: 159111756
• Molecular Formula: C155H182F2N48O5S6
• Molecular Weight: 3027.89 g/mol
• Exact Mass: 3025.38
• IUPAC Name: 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine
• SMILES: C1=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CCN(CCCN2CCCCC2)C1.CC(C)(C)NCCNC(=O)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.CC1CN(CCNC(=O)N2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)CC(C)N1.CN1CCN(CCCN2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)CC1.O=C(NCCN1CCC(F)(F)CC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NCCN1CCC(O)C1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1
• InChI: InChI=1S/C27H33N9OS.C26H28F2N8OS.C26H32N8S.C26H31N7S.C25H28N8O2S.C25H30N8OS/c1-17-13-35(14-18(2)32-17)10-7-28-27(37)36-8-5-19(6-9-36)23-12-21-25(29-15-30-26(21)34-23)33-20-3-4-22-24(11-20)38-16-31-22;27-26(28)5-10-35(11-6-26)12-7-29-25(37)36-8-3-17(4-9-36)21-14-19-23(30-15-31-24(19)34-21)33-18-1-2-20-22(13-18)38-16-32-20;1-32-11-13-34(14-12-32)8-2-7-33-9-5-19(6-10-33)23-16-21-25(27-17-28-26(21)31-23)30-20-3-4-22-24(15-20)35-18-29-22;1-2-9-32(10-3-1)11-4-12-33-13-7-19(8-14-33)23-16-21-25(27-17-28-26(21)31-23)30-20-5-6-22-24(15-20)34-18-29-22;34-18-5-7-32(13-18)10-6-26-25(35)33-8-3-16(4-9-33)21-12-19-23(27-14-28-24(19)31-21)30-17-1-2-20-22(11-17)36-15-29-20;1-25(2,3)30-9-8-26-24(34)33-10-6-16(7-11-33)20-13-18-22(27-14-28-23(18)32-20)31-17-4-5-19-21(12-17)35-15-29-19/h3-5,11-12,15-18,32H,6-10,13-14H2,1-2H3,(H,28,37)(H2,29,30,33,34);1-3,13-16H,4-12H2,(H,29,37)(H2,30,31,33,34);3-5,15-18H,2,6-14H2,1H3,(H2,27,28,30,31);5-7,15-18H,1-4,8-14H2,(H2,27,28,30,31);1-3,11-12,14-15,18,34H,4-10,13H2,(H,26,35)(H2,27,28,30,31);4-6,12-15,30H,7-11H2,1-3H3,(H,26,34)(H2,27,28,31,32)
• InChIKey: KEOYFBRFLWBHNW-UHFFFAOYSA-N
• XLogP: 25.62
• TPSA: 598.51 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 45
• Rotatable Bonds: 38
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3027.89
LogP ≤ 5	25.62
H-Bond Donors ≤ 5	19
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-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine?

The IUPAC name of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine (CID 159111756) is 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine.

What is the SMILES notation for 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine?

The canonical SMILES for 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine is C1=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CCN(CCCN2CCCCC2)C1.CC(C)(C)NCCNC(=O)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.CC1CN(CCNC(=O)N2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)CC(C)N1.CN1CCN(CCCN2CC=C(c3cc4c(Nc5ccc6ncsc6c5)ncnc4[nH]3)CC2)CC1.O=C(NCCN1CCC(F)(F)CC1)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1.O=C(NCCN1CCC(O)C1)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-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine?

The InChIKey is KEOYFBRFLWBHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N9OS.C26H28F2N8OS.C26H32N8S.C26H31N7S.C25H28N8O2S.C25H30N8OS/c1-17-13-35(14-18(2)32-17)10-7-28-27(37)36-8-5-19(6-9-36)23-12-21-25(29-15-30-26(21)34-23)33-20-3-4-22-24(11-20)38-16-31-22;27-26(28)5-10-35(11-6-26)12-7-29-25(37)36-8-3-17(4-9-36)21-14-19-23(30-15-31-24(19)34-21)33-18-1-2-20-22(13-18)38-16-32-20;1-32-11-13-34(14-12-32)8-2-7-33-9-5-19(6-10-33)23-16-21-25(27-17-28-26(21)31-23)30-20-3-4-22-24(15-20)35-18-29-22;1-2-9-32(10-3-1)11-4-12-33-13-7-19(8-14-33)23-16-21-25(27-17-28-26(21)31-23)30-20-5-6-22-24(15-20)34-18-29-22;34-18-5-7-32(13-18)10-6-26-25(35)33-8-3-16(4-9-33)21-12-19-23(27-14-28-24(19)31-21)30-17-1-2-20-22(11-17)36-15-29-20;1-25(2,3)30-9-8-26-24(34)33-10-6-16(7-11-33)20-13-18-22(27-14-28-23(18)32-20)31-17-4-5-19-21(12-17)35-15-29-19/h3-5,11-12,15-18,32H,6-10,13-14H2,1-2H3,(H,28,37)(H2,29,30,33,34);1-3,13-16H,4-12H2,(H,29,37)(H2,30,31,33,34);3-5,15-18H,2,6-14H2,1H3,(H2,27,28,30,31);5-7,15-18H,1-4,8-14H2,(H2,27,28,30,31);1-3,11-12,14-15,18,34H,4-10,13H2,(H,26,35)(H2,27,28,30,31);4-6,12-15,30H,7-11H2,1-3H3,(H,26,34)(H2,27,28,31,32).

What are the key properties of 4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine?

4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine has a molecular weight of 3027.89 g/mol, XLogP of 25.62, 38 rotatable bonds, 19 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-[2-(tert-butylamino)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3,5-dimethylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;4-[4-(1,3-benzothiazol-6-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-N-[2-(3-hydroxypyrrolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridine-1-carboxamide;N-[6-[1-[3-(4-methylpiperazin-1-yl)propyl]-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine;N-[6-[1-(3-piperidin-1-ylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,3-benzothiazol-6-amine is sourced from PubChem (CID 159111756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).