TI-189

N-amino-N'-[(4S)-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-(4-methylpiperidin-1-yl)-5-oxopentyl]methanimidamide

Also Known As: TI 189|TI-189|N-amino-N'-[(4S)-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-(4-methylpiperidin-1-yl)-5-oxopentyl]methanimidamide|4-Methyl-1-(N(2)-(5,6-dimethylaminonaphthalene)-1-sulfonyl-L-arginyl)piperidine|4-Methyl-1-(N(2)-(5-dimethylaminonaphthalene)-1-sulfonyl-L-arginyl)piperidine|Piperidine, 1-(5-((aminoiminomethyl)amino)-2-(((5-(dimethylamino)-1-naphthalenyl)sulfonyl)amino)-1-oxopentyl)-4-methyl-, (S)-|3-(2,3,5,9-Tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-propionic acid|5-(dimethylamino)-N-(5-guanidino-1-(4-methylpiperidin-1-yl)-1-oxopentan-2-yl)naphthalene-1-sulfonamide|5-(Dimethylamino)-N-[(2S)-5-[(hydrazinylmethylidene)amino]-1-(4-methylpiperidin-1-yl)-1-oxopentan-2-yl]naphthalene-1-sulfonamide|5-(Dimethylamino)-N-{5-[(hydrazinylmethylidene)amino]-1-(4-methylpiperidin-1-yl)-1-oxopentan-2-yl}naphthalene-1-sulfonamide|N-amino-N'-[(4S)-4-[(5-dimethylaminonaphthalen-1-yl)sulfonylamino]-5-(4-methylpiperidin-1-yl)-5-oxopentyl]methanimidamide

Molecular Formula	C24H36N6O3S
Molecular Weight	488.25696 g/mol
LogP	2.5
Topological Polar Surface Area	129.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	488.25696
Monoisotopic Mass	488.25696
Heavy Atoms	34
Complexity	776.0

Chemical Identifiers

CAS Number	77787-46-3
SMILES	CC1CCN(CC1)C(=O)[C@H](CCCN=CNN)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C
InChIKey	LEHVOVFBWKETSG-NRFANRHFSA-N