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BI-RG-587 analog structure
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BI-RG-587 analog

TL;DR: BI-RG-587 analog (CAS 133627-27-7) is a chemical compound with molecular formula C16H18N4O and molecular weight 282.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-ethyl-5,6,9-trimethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one

Also Known As: BI-RG-587 analog, Dipyridodiazepinone deriv. 105, N11-Ethyl-2,3,N5-trimethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one, N11-Ethyl-2,3,N5-trimethyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one, 11-ethyl-2,3,5-trimethyl-dipyrido[[?],[?]][1,4]diazepin-6-one

CAS Number
133627-27-7
Molecular Formula
C16H18N4O
Molecular Weight
282.14807 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC16H18N4O
Molecular Weight282.14807 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)49.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass282.14807 Da
Heavy Atoms21
Complexity402.0
SMILESCCN1C2=C(C=CC=N2)C(=O)N(C3=C1N=C(C(=C3)C)C)C
InChIKeyBEDHGLWDRNTRSG-UHFFFAOYSA-N

Chemical Property Profile of BI-RG-587 analog

XLogP
2.4
TPSA (Topological Polar Surface Area)
49.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
21
Complexity
402.0
Exact Mass
282.14807
Monoisotopic Mass
282.14807
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of BI-RG-587 analog

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BI-RG-587 analog. With a topological polar surface area (TPSA) of 49.3 Ų, BI-RG-587 analog exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BI-RG-587 analog has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of BI-RG-587 analog?

The CAS number of BI-RG-587 analog is 133627-27-7.

What is the molecular formula of BI-RG-587 analog?

The molecular formula of BI-RG-587 analog is C16H18N4O.

What is the molecular weight of BI-RG-587 analog?

The molecular weight of BI-RG-587 analog is 282.14807 g/mol.

Where can I buy BI-RG-587 analog?

You can request a quote for BI-RG-587 analog directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for BI-RG-587 analog?

Yes, CoreyChem provides custom synthesis services for BI-RG-587 analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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