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BS-181 hydrochloride

BS-181 hydrochloride structure

BS-181 hydrochloride 

structure
  • CAS No:

    1092443-52-1

  • Formula:

    C22H32N6

  • Chemical Name:

    BS-181 hydrochloride

  • Synonyms:

    BS-181 hydrochloride;BS 181;N5-(6-Aminohexyl)-3-isopropyl-N7-benzylpyrazolo[1,5-a]pyrimidine-5,7-diamine;BS-181 HCl

Description

BS-181 is a highly selective CDK7 inhibitor with an IC50 of 21 nM, showing 40-fold selective over CDK1, 2, 4, 5, 6, or 9.


N5-(6-aminohexyl)-N7-(phenylmethyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine-5,7-diamine is a pyrazolopyrimidine.

BS-181 hydrochloride Basic Attributes

380.54

380.269

75M620LLBN

Characteristics

80.27000

6.04410

1.16

Drug Information

BS-181

Computed Properties

Molecular Weight:380.5
XLogP3:4.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:380.26884505
Monoisotopic Mass:380.26884505
Topological Polar Surface Area:80.3
Heavy Atom Count:28
Complexity:425
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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