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Ro 3306

Ro 3306 structure

CAS No:
872573-93-8
Formula:
C18H13N3OS2
Chemical Name:
Ro 3306
Synonyms:
Ro 3306;2-[[(Thiophen-2-yl)methyl]amino]-5-[1-(quinolin-6-yl)meth-(Z)-ylidene]thiazol-4-one;(Z)-5-(quinolin-6-ylmethylene)-2-(thiophen-2-ylmethylamino)thiazol-4(5H)-one;(5Z)-5-Quinolin-6-ylmethylene-2-[(thiophen-2-ylmethyl)-amino]-thiazol-4-one;5-(6-Quinolinylmethylene)-2-[(2-thienylmethyl)amino]-4(5H)-thiazolone
Categories:
Biochemical Engineering > Inhibitors

Description

Ro-3306 is a potent and selective inhibitor of CDK1, with Kis of 20 nM, 35 nM and 340 nM for CDK1, CDK1/cyclin B1 and CDK2/cyclin E, respectively.

5-(6-quinolinylmethylidene)-2-(thiophen-2-ylmethylamino)-4-thiazolone is a member of quinolines.

Ro 3306 Basic Attributes

Molecular Weight：

351.44532

Exact Mass：

351.049988

Characteristics

Appearance：

white to light brown

Density：

1.4±0.1 g/cm3

Boiling Point：

569.1±60.0°C at 760 mmHg

Flash Point：

298.0±32.9 °C

Refractive Index：

1.746

Water Solubility：

DMSO: soluble5mg/mL, clear

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Computed Properties

Molecular Weight:351.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:351.05000439
Monoisotopic Mass:351.05000439
Topological Polar Surface Area:108
Heavy Atom Count:24
Complexity:548
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes