BI-RG-587 analog
TL;DR: BI-RG-587 analog (CAS 133627-29-9) is a chemical compound with molecular formula C14H14ClN5O and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-6-chloro-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
Also Known As: BI-RG-587 analog, Dipyridodiazepinone deriv. 107, 2-Amino-3-chloro-N11-ethyl-N5-methyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one, 2-Amino-3-chloro-N11-ethyl-N5-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one, 2-amino-3-chloro-11-ethyl-5-methyl-dipyrido[[?],[?]][1,4]diazepin-6-one
| Molecular Formula | C14H14ClN5O |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 303.08868 |
| Heavy Atoms | 21 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 133627-29-9 |
|---|---|
| SMILES | CCN1C2=C(C=CC=N2)C(=O)N(C3=CC(=C(N=C31)N)Cl)C |
| InChIKey | YGMLAMYARKBNAY-UHFFFAOYSA-N |
Product Overview
BI-RG-587 analog (CAS 133627-29-9), with molecular formula C14H14ClN5O and molecular weight 303.09 g/mol. IUPAC: 5-amino-6-chloro-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one.
Chemical Property Profile of BI-RG-587 analog
Property Insights of BI-RG-587 analog
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BI-RG-587 analog. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BI-RG-587 analog. Following Lipinski's Rule of Five, BI-RG-587 analog has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BI-RG-587 analog?
The CAS number of BI-RG-587 analog is 133627-29-9.
What is the molecular formula of BI-RG-587 analog?
The molecular formula of BI-RG-587 analog is C14H14ClN5O.
What is the molecular weight of BI-RG-587 analog?
The molecular weight of BI-RG-587 analog is 303.09 g/mol.
Where can I buy BI-RG-587 analog?
You can request a quote for BI-RG-587 analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BI-RG-587 analog?
Yes, KEHONG BIO provides custom synthesis services for BI-RG-587 analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.