1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea

C102H114N34O10S — CID 159243312

IUPAC1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea
SMILESCC(=O)Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2s1.CN(C)CCNC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.CN1CCNCC1.Cc1ncccc1NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2o1
InChIInChI=1S/C23H23N7O2.C21H27N7O2.C19H18N6O2S.C17H16N6O2.C17H18N6O2.C5H12N2/c1-16-19(4-2-10-24-16)26-23(31)25-18-8-6-17(7-9-18)21-27-22(29-12-14-32-15-13-29)20-5-3-11-30(20)28-21;1-26(2)11-9-22-21(29)23-17-7-5-16(6-8-17)19-24-20(27-12-14-30-15-13-27)18-4-3-10-28(18)25-19;1-12(26)20-19-21-14-5-4-13(11-16(14)28-19)17-22-18(24-7-9-27-10-8-24)15-3-2-6-25(15)23-17;18-17-19-12-4-3-11(10-14(12)25-17)15-20-16(22-6-8-24-9-7-22)13-2-1-5-23(13)21-15;18-17(24)19-13-5-3-12(4-6-13)15-20-16(22-8-10-25-11-9-22)14-2-1-7-23(14)21-15;1-7-4-2-6-3-5-7/h2-11H,12-15H2,1H3,(H2,25,26,31);3-8,10H,9,11-15H2,1-2H3,(H2,22,23,29);2-6,11H,7-10H2,1H3,(H,20,21,26);1-5,10H,6-9H2,(H2,18,19);1-7H,8-11H2,(H3,18,19,24);6H,2-5H2,1H3
InChIKeyKUJCZIOQFLGBRW-UHFFFAOYSA-N
MW2008.33 g/mol
LogP11.50
Rot. Bonds18

About 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea

1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea (PubChem CID 159243312) has the molecular formula C102H114N34O10S and a molecular weight of 2008.33 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea
PubChem CID159243312
Molecular FormulaC102H114N34O10S
Molecular Weight2008.33 g/mol
Exact Mass2006.92
IUPAC Name1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea
SMILESCC(=O)Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2s1.CN(C)CCNC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.CN1CCNCC1.Cc1ncccc1NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2o1
InChIInChI=1S/C23H23N7O2.C21H27N7O2.C19H18N6O2S.C17H16N6O2.C17H18N6O2.C5H12N2/c1-16-19(4-2-10-24-16)26-23(31)25-18-8-6-17(7-9-18)21-27-22(29-12-14-32-15-13-29)20-5-3-11-30(20)28-21;1-26(2)11-9-22-21(29)23-17-7-5-16(6-8-17)19-24-20(27-12-14-30-15-13-27)18-4-3-10-28(18)25-19;1-12(26)20-19-21-14-5-4-13(11-16(14)28-19)17-22-18(24-7-9-27-10-8-24)15-3-2-6-25(15)23-17;18-17-19-12-4-3-11(10-14(12)25-17)15-20-16(22-6-8-24-9-7-22)13-2-1-5-23(13)21-15;18-17(24)19-13-5-3-12(4-6-13)15-20-16(22-8-10-25-11-9-22)14-2-1-7-23(14)21-15;1-7-4-2-6-3-5-7/h2-11H,12-15H2,1H3,(H2,25,26,31);3-8,10H,9,11-15H2,1-2H3,(H2,22,23,29);2-6,11H,7-10H2,1H3,(H,20,21,26);1-5,10H,6-9H2,(H2,18,19);1-7H,8-11H2,(H3,18,19,24);6H,2-5H2,1H3
InChIKeyKUJCZIOQFLGBRW-UHFFFAOYSA-N
XLogP11.50
TPSA476.12 Ų
H-Bond Donors9
H-Bond Acceptors38
Rotatable Bonds18
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002008.33
LogP ≤ 511.50
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1038

Analyze 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea with MolForge

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Related Compounds

2,3-dimethyl-1,3-benzothiazol-3-ium;2,3-dimethyl-2H-1,3-benzoxazole;2,3-dimethyl-1,3-oxazol-3-ium;1,2-dimethylpyrimidin-1-ium;1,2-dimethyl-5-(trifluoromethyl)pyridin-1-ium;3-methyldithiol-1-ium;2-methyl-1,3-oxazole;2-methylpyrylium;2-methylthiopyrylium;1,2,3-trimethylbenzimidazol-3-ium;1,2,3-trimethyl-2H-imidazole-1,3-diium;1,2,3-trimethylpyrazol-1-ium;1,4,5-trimethyl-1,2,4-triazol-4-ium
CID 160116091
2-Tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;1-tert-butyl-2-methylimidazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butylpyridazine;5-tert-butylpyridine-2-carboxamide;5-tert-butyl-2-(trifluoromethyl)pyridine
CID 160783516
1-[5-(1,3-benzoxazol-2-ylmethyl)-1,3-thiazol-2-yl]-1-[[5-(1H-imidazo[4,5-b]pyridin-2-ylmethyl)-1,3-thiazol-2-yl]-[[4-methyl-2-(2-methylpropoxy)phenyl]carbamoyl]amino]-3-[4-methyl-2-(2-methylpropoxy)phenyl]urea
CID 67488014
1-[5-(1,3-benzoxazol-2-ylmethyl)-1,3-thiazol-2-yl]-3-[4-methyl-2-(2-methylpropoxy)phenyl]urea;1-[5-(1H-imidazo[4,5-b]pyridin-2-ylmethyl)-1,3-thiazol-2-yl]-3-[4-methyl-2-(2-methylpropoxy)phenyl]urea
CID 87418994
1-benzofuran;1,3-benzothiazole;1-benzothiophene;2H-benzotriazole;1,3-benzoxazole;ethane;imidazo[1,2-a]pyridine;1H-indazole;1H-indole;pyrazolo[1,5-a]pyridine;1H-pyrazolo[3,4-b]pyrazine;1H-pyrazolo[4,5-b]pyridine;1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[4,5-c]pyridine;1H-pyrazolo[5,4-c]pyridine;1H-pyrazolo[3,4-d]pyrimidine;1H-pyrazolo[4,3-d]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[3,2-c]pyridine;2H-triazolo[4,5-b]pyrazine;2H-triazolo[4,5-b]pyridine;2H-triazolo[4,5-c]pyridine;2H-triazolo[4,5-d]pyrimidine
CID 157069338
(5S)-7-[2-[4-[4-[5-(ethylamino)-1,3-oxazol-2-yl]phenyl]-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]-2-[3-(6-propan-2-yloxy-3-pyridinyl)-1H-isoindol-5-yl]-2,7-diazaspiro[4.4]nonan-1-one;(5S)-7-[2-[4-[4-[5-(ethylamino)-1,3-thiazol-2-yl]phenyl]-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]-2-[3-(6-propan-2-yloxy-3-pyridinyl)-1H-isoindol-5-yl]-2,7-diazaspiro[4.4]nonan-1-one;(5S)-2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-7-[2-[4-[4-(1-methyl-1,2,4-triazol-3-yl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]-2,7-diazaspiro[4.4]nonan-1-one
CID 157139649
5-propan-2-yl-2H-benzimidazole;6-propan-2-yl-1H-benzimidazole;bis(5-propan-2-yl-2,1,3-benzothiadiazole);bis(6-propan-2-yl-1,3-benzothiazole);bis(6-propan-2-yl-1,3-benzoxazole);bis(6-propan-2-yl-2,3-dihydro-1-benzothiophene);7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;bis(6-propan-2-ylimidazo[1,2-a]pyridine);6-propan-2-ylimidazo[1,2-b]pyridazine;5-propan-2-yl-2H-indole;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 157160459
1,2-dimethylbenzimidazole;2,4-dimethyl-1,3-benzoxazole;2,5-dimethyl-1,3-benzoxazole;2,6-dimethyl-1,3-benzoxazole;2,7-dimethyl-1,3-benzoxazole;ethylbenzene;5-ethyl-2-methyltetrazole;2-ethyl-[1,3]oxazolo[4,5-c]pyridine;2-ethyl-[1,3]oxazolo[5,4-c]pyridine;3-ethylpyridazine;2-ethylpyridine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methyl-[1,3]oxazolo[4,5-b]pyridine;2-methyl-[1,3]oxazolo[5,4-b]pyridine;6-methyl-[1,3]oxazolo[4,5-c]pyridazine;2-methylpyrazine;2-methylpyrimidine;4-methylpyrimidine
CID 157203568
methane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylbenzotriazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylfuro[2,3-b]pyridine;2-propan-2-yl-[1,3]oxazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]oxazolo[5,4-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-ylthieno[2,3-b]pyridine
CID 157217197
1-hydroxy-3-methylpyridin-1-ium;1-hydroxy-4-methylpyridin-1-ium;6-methyl-1H-benzimidazole;6-methyl-1,3-benzothiazole;6-methyl-1,3-benzoxazole;2-methylfuran;2-methylpyrazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylthiophene
CID 157258149
4-methyl-2-propan-2-yl-1,3-benzothiazole;1-methyl-4-propan-2-ylpyrazolo[3,4-d]pyrimidine;7-methyl-4-propan-2-ylpyrrolo[2,3-d]pyrimidine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;4-propan-2-yl-7H-cyclopenta[d]pyrimidine;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;7-propan-2-yl-1H-pyrazolo[4,5-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[3,4-d]pyrimidine
CID 157264548
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;3-propan-2-ylcinnoline;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-propan-2-yl-2,3-dihydropyrrolo[2,3-b]pyridine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylisoindole-1,3-dione;2-propan-2-yl-3H-isoindol-1-one;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,5-naphthyridine;2-propan-2-yl-1,8-naphthyridine;2-propan-2-ylpteridine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-propan-2-ylquinazoline;2-propan-2-ylquinoline;2-propan-2-ylquinoxaline
CID 157265838

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea (CID 159243312) is 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea is CC(=O)Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2s1.CN(C)CCNC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.CN1CCNCC1.Cc1ncccc1NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.NC(=O)Nc1ccc(-c2nc(N3CCOCC3)c3cccn3n2)cc1.Nc1nc2ccc(-c3nc(N4CCOCC4)c4cccn4n3)cc2o1.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea?
The InChIKey is KUJCZIOQFLGBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O2.C21H27N7O2.C19H18N6O2S.C17H16N6O2.C17H18N6O2.C5H12N2/c1-16-19(4-2-10-24-16)26-23(31)25-18-8-6-17(7-9-18)21-27-22(29-12-14-32-15-13-29)20-5-3-11-30(20)28-21;1-26(2)11-9-22-21(29)23-17-7-5-16(6-8-17)19-24-20(27-12-14-30-15-13-27)18-4-3-10-28(18)25-19;1-12(26)20-19-21-14-5-4-13(11-16(14)28-19)17-22-18(24-7-9-27-10-8-24)15-3-2-6-25(15)23-17;18-17-19-12-4-3-11(10-14(12)25-17)15-20-16(22-6-8-24-9-7-22)13-2-1-5-23(13)21-15;18-17(24)19-13-5-3-12(4-6-13)15-20-16(22-8-10-25-11-9-22)14-2-1-7-23(14)21-15;1-7-4-2-6-3-5-7/h2-11H,12-15H2,1H3,(H2,25,26,31);3-8,10H,9,11-15H2,1-2H3,(H2,22,23,29);2-6,11H,7-10H2,1H3,(H,20,21,26);1-5,10H,6-9H2,(H2,18,19);1-7H,8-11H2,(H3,18,19,24);6H,2-5H2,1H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea?
1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea has a molecular weight of 2008.33 g/mol, XLogP of 11.50, 18 rotatable bonds, 9 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;1-methylpiperazine;1-(2-methyl-3-pyridinyl)-3-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea;N-[6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzothiazol-2-yl]acetamide;6-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)-1,3-benzoxazol-2-amine;[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]urea is sourced from PubChem (CID 159243312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).