C245H240F6N86O27 — CID 160845370
1-[3-(dibenzofuran-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[6-(dimethylamino)hexyl]-3-[3-(4-hydroxy-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;6-[[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]amino]naphthalene-2-carboxylic acid;1-ethyl-3-[3-(1H-indol-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-methoxy-5-(trifluoromethyl)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(3-oxo-4H-1,4-benzoxazin-7-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-oxo-1H-quinolin-2-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-propan-2-yloxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(pyrimidin-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinolin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinoxalin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-(trifluoromethoxy)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea (PubChem CID 160845370) has the molecular formula C245H240F6N86O27 and a molecular weight of 4935.18 g/mol. Its IUPAC name is 1-[3-(dibenzofuran-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[6-(dimethylamino)hexyl]-3-[3-(4-hydroxy-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;6-[[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]amino]naphthalene-2-carboxylic acid;1-ethyl-3-[3-(1H-indol-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-methoxy-5-(trifluoromethyl)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(3-oxo-4H-1,4-benzoxazin-7-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-oxo-1H-quinolin-2-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-propan-2-yloxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(pyrimidin-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinolin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinoxalin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-(trifluoromethoxy)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea.
| Compound Name | 1-[3-(dibenzofuran-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[6-(dimethylamino)hexyl]-3-[3-(4-hydroxy-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;6-[[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]amino]naphthalene-2-carboxylic acid;1-ethyl-3-[3-(1H-indol-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-methoxy-5-(trifluoromethyl)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(3-oxo-4H-1,4-benzoxazin-7-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-oxo-1H-quinolin-2-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-propan-2-yloxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(pyrimidin-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinolin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinoxalin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-(trifluoromethoxy)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea |
|---|---|
| PubChem CID | 160845370 |
| Molecular Formula | C245H240F6N86O27 |
| Molecular Weight | 4935.18 g/mol |
| Exact Mass | 4932.00 |
| IUPAC Name | 1-[3-(dibenzofuran-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[6-(dimethylamino)hexyl]-3-[3-(4-hydroxy-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;6-[[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]amino]naphthalene-2-carboxylic acid;1-ethyl-3-[3-(1H-indol-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-methoxy-5-(trifluoromethyl)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(3-oxo-4H-1,4-benzoxazin-7-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-oxo-1H-quinolin-2-yl)amino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-propan-2-yloxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(pyrimidin-2-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinolin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(quinoxalin-6-ylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[3-(trifluoromethoxy)anilino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyanilino)pyrido[2,3-b]pyrazin-6-yl]urea |
| SMILES | CCNC(=O)Nc1ccc2ncc(Nc3cc(=O)c4ccccc4[nH]3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3cc(OC)c(OC)c(OC)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3cc(OC)cc(C(F)(F)F)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(OC(C)C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4c(c3)OCC(=O)N4)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4cc(C(=O)O)ccc4c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4cc[nH]c4c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4ncccc4c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4nccnc4c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc4oc5ccccc5c4c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3cccc(OC(F)(F)F)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ncccn3)nc2n1.COc1cc(-c2cnc3ccc(NC(=O)NCCCCCCN(C)C)nc3n2)ccc1O |
| InChI | InChI=1S/C23H30N6O3.C22H18N6O2.C21H18N6O3.C19H17N7O2.C19H17N7O.C19H22N6O4.C19H22N6O2.C18H17F3N6O2.C18H16N8O.C18H17N7O3.C18H17N7O.C17H15F3N6O2.C14H14N8O/c1-29(2)13-7-5-4-6-12-24-23(31)28-21-11-9-17-22(27-21)26-18(15-25-17)16-8-10-19(30)20(14-16)32-3;1-2-23-22(29)28-19-10-8-16-21(26-19)27-20(12-24-16)25-13-7-9-18-15(11-13)14-5-3-4-6-17(14)30-18;1-2-22-21(30)27-17-8-7-16-19(25-17)26-18(11-23-16)24-15-6-5-12-9-14(20(28)29)4-3-13(12)10-15;1-2-20-19(28)26-15-8-7-13-18(24-15)25-17(10-21-13)23-16-9-14(27)11-5-3-4-6-12(11)22-16;1-2-20-19(27)26-16-8-7-15-18(24-16)25-17(11-22-15)23-13-5-6-14-12(10-13)4-3-9-21-14;1-5-20-19(26)25-15-7-6-12-18(23-15)24-16(10-21-12)22-11-8-13(27-2)17(29-4)14(9-11)28-3;1-4-20-19(26)25-16-10-9-15-18(23-16)24-17(11-21-15)22-13-5-7-14(8-6-13)27-12(2)3;1-3-22-17(28)27-14-5-4-13-16(25-14)26-15(9-23-13)24-11-6-10(18(19,20)21)7-12(8-11)29-2;1-2-19-18(27)26-15-6-5-13-17(24-15)25-16(10-22-13)23-11-3-4-12-14(9-11)21-8-7-20-12;1-2-19-18(27)25-14-6-5-12-17(23-14)24-15(8-20-12)21-10-3-4-11-13(7-10)28-9-16(26)22-11;1-2-19-18(26)25-15-6-5-13-17(23-15)24-16(10-21-13)22-12-4-3-11-7-8-20-14(11)9-12;1-2-21-16(27)26-13-7-6-12-15(24-13)25-14(9-22-12)23-10-4-3-5-11(8-10)28-17(18,19)20;1-2-15-14(23)22-10-5-4-9-12(19-10)20-11(8-18-9)21-13-16-6-3-7-17-13/h8-11,14-15,30H,4-7,12-13H2,1-3H3,(H2,24,26,27,28,31);3-12H,2H2,1H3,(H3,23,25,26,27,28,29);3-11H,2H2,1H3,(H,28,29)(H3,22,24,25,26,27,30);3-10H,2H2,1H3,(H4,20,22,23,24,25,26,27,28);3-11H,2H2,1H3,(H3,20,23,24,25,26,27);6-10H,5H2,1-4H3,(H3,20,22,23,24,25,26);5-12H,4H2,1-3H3,(H3,20,22,23,24,25,26);4-9H,3H2,1-2H3,(H3,22,24,25,26,27,28);3-10H,2H2,1H3,(H3,19,23,24,25,26,27);3-8H,2,9H2,1H3,(H,22,26)(H3,19,21,23,24,25,27);3-10,20H,2H2,1H3,(H3,19,22,23,24,25,26);3-9H,2H2,1H3,(H3,21,23,24,25,26,27);3-8H,2H2,1H3,(H3,15,16,17,19,20,21,22,23) |
| InChIKey | SIOOPRHNMGCSHV-UHFFFAOYSA-N |
| XLogP | 42.99 |
| TPSA | 1471.71 Ų |
| H-Bond Donors | 43 |
| H-Bond Acceptors | 83 |
| Rotatable Bonds | 66 |
| Heavy Atoms | 364 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4935.18 |
| LogP ≤ 5 | 42.99 |
| H-Bond Donors ≤ 5 | 43 |
| H-Bond Acceptors ≤ 10 | 83 |