BAS 00537029
TL;DR: BAS 00537029 (CAS 303039-45-4) is a chemical compound with molecular formula C23H15BrN2O2 and molecular weight 430.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(5-bromo-2-pyridinyl)-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Also Known As: BAS 00537029, BIM-0036929.P001, AB00100648-01, 17-(5-bromopyridin-2-yl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name), 13-(5-bromopyridin-2-yl)-10,11-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(13H,15H)-dione
| Molecular Formula | C23H15BrN2O2 |
|---|---|
| Molecular Weight | 430.03 g/mol |
| LogP | 4.2407 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 430.03168 |
| Heavy Atoms | 28 |
| Complexity | 1041.7737 |
Chemical Identifiers
| CAS Number | 303039-45-4 |
|---|---|
| SMILES | C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=NC=C(C=C6)Br |
Product Overview
BAS 00537029 (CAS 303039-45-4), with molecular formula C23H15BrN2O2 and molecular weight 430.03 g/mol. IUPAC: 17-(5-bromo-2-pyridinyl)-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione.
Chemical Property Profile of BAS 00537029
Property Insights of BAS 00537029
The XLogP value of 4.2407 indicates that BAS 00537029 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.27 Ų, BAS 00537029 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00537029 has 0 hydrogen bond donor(s) and 3 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 BAS 00537029?
The CAS number of BAS 00537029 is 303039-45-4.
What is the molecular formula of BAS 00537029?
The molecular formula of BAS 00537029 is C23H15BrN2O2.
What is the molecular weight of BAS 00537029?
The molecular weight of BAS 00537029 is 430.03 g/mol.
Where can I buy BAS 00537029?
You can request a quote for BAS 00537029 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00537029?
Yes, KEHONG BIO provides custom synthesis services for BAS 00537029 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.