BAS 00655988
TL;DR: BAS 00655988 (CAS 331944-92-4) is a chemical compound with molecular formula C24H15Br2NO3 and molecular weight 522.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-dibromo-17-(4-hydroxyphenyl)-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 00655988, 1,8-dibromo-17-(4-hydroxyphenyl)-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, 1,8-dibromo-17-(4-hydroxyphenyl)-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), 1,8-dibromo-17-(4-hydroxyphenyl)-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
| Molecular Formula | C24H15Br2NO3 |
|---|---|
| Molecular Weight | 522.94 g/mol |
| LogP | 4.802 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 522.9419 |
| Heavy Atoms | 30 |
| Complexity | 1131.8157 |
Chemical Identifiers
| CAS Number | 331944-92-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3(C4C(C2(C5=CC=CC=C53)Br)C(=O)N(C4=O)C6=CC=C(C=C6)O)Br |
Product Overview
BAS 00655988 (CAS 331944-92-4), with molecular formula C24H15Br2NO3 and molecular weight 522.94 g/mol. IUPAC: 1,8-dibromo-17-(4-hydroxyphenyl)-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 00655988
Property Insights of BAS 00655988
The XLogP value of 4.802 indicates that BAS 00655988 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, BAS 00655988 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00655988 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00655988?
The CAS number of BAS 00655988 is 331944-92-4.
What is the molecular formula of BAS 00655988?
The molecular formula of BAS 00655988 is C24H15Br2NO3.
What is the molecular weight of BAS 00655988?
The molecular weight of BAS 00655988 is 522.94 g/mol.
Where can I buy BAS 00655988?
You can request a quote for BAS 00655988 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00655988?
Yes, KEHONG BIO provides custom synthesis services for BAS 00655988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.