Catalog No.:AA01ENGJ

1246030-96-5 | trans-4-[[4-[(6-Ethyl-2-benzothiazolyl)amino]-6-(phenylmethyl)-2-pyrimidinyl]amino]cyclohexanol

Name: Name:trans-4-[[4-[(6-Ethyl-2-benzothiazolyl)amino]-6-(phenylmethyl)-2-pyrimidinyl]amino]cyclohexanol
Brand: AABLOCKS
SKU: AA01ENGJ
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5mg

≥97%(HPLC)

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$413.00 $289.00

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA01ENGJ

Chemical Name:

trans-4-[[4-[(6-Ethyl-2-benzothiazolyl)amino]-6-(phenylmethyl)-2-pyrimidinyl]amino]cyclohexanol

CAS Number:

1246030-96-5

Molecular Formula:

C26H29N5OS

Molecular Weight:

459.6064

MDL Number:

MFCD31544486

SMILES:

CCc1ccc2c(c1)sc(n2)Nc1cc(Cc2ccccc2)nc(n1)N[C@@H]1CC[C@H](CC1)O

Properties

Computed Properties

Complexity:

597

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

6.6

Literature

Title: Alder CM, et al. Identification of a Novel and Selective Series of Itk Inhibitors via a Template-Hopping Strategy. ACS Med Chem Lett. 2013 Aug 12;4(10):948-52.

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