Bastadin 21
TL;DR: Bastadin 21 (CAS 437762-27-1) is a chemical compound with molecular formula C34H29Br3N4O8 and molecular weight 857.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(12E,25E)-16,21,32-tribromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3,5,7(38),14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione
Also Known As: Bastadin 21, (12E,25E)-16,21,32-tribromo-4,17-dihydroxy-2,19-dioxa-10,27-diazapentacyclo[28.2.2.2~20,23~.1~3,7~.1~14,18~]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,12,25,26-tetrone 12,2, 2,19-dioxa-10,27-diazapentacyclo[28.2.2.2~20,23~.1~3,7~.1~14,18~]octatriaconta-3,5,7(38),14,16,18(37),20,22,30,32,33,35-dodecaene-11,12,25,26-tetrone, 16,21,32-tribromo-4,17-dihydroxy-, 12,25-dioxime,, RefChem:116644
| Molecular Formula | C34H29Br3N4O8 |
|---|---|
| Molecular Weight | 857.95 g/mol |
| LogP | 6.7465 |
| Topological Polar Surface Area | 182.3 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 857.95355 |
| Heavy Atoms | 49 |
| Complexity | 1968.3373 |
Chemical Identifiers
| CAS Number | 437762-27-1 |
|---|---|
| SMILES | C1CNC(=O)/C(=N/O)/CC2=CC(=C(C(=C2)Br)O)OC3=C(C=C(C/C(=N\O)/C(=O)NCCC4=CC(=C(C=C4)OC5=C(C=CC1=C5)O)Br)C=C3)Br |
Product Overview
Bastadin 21 (CAS 437762-27-1), with molecular formula C34H29Br3N4O8 and molecular weight 857.95 g/mol. IUPAC: (12E,25E)-16,21,32-tribromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3,5,7(38),14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione.
Chemical Property Profile of Bastadin 21
Property Insights of Bastadin 21
The XLogP value of 6.7465 indicates that Bastadin 21 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 182.3 Ų indicates high polarity, suggesting Bastadin 21 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bastadin 21 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bastadin 21?
The CAS number of Bastadin 21 is 437762-27-1.
What is the molecular formula of Bastadin 21?
The molecular formula of Bastadin 21 is C34H29Br3N4O8.
What is the molecular weight of Bastadin 21?
The molecular weight of Bastadin 21 is 857.95 g/mol.
Where can I buy Bastadin 21?
You can request a quote for Bastadin 21 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bastadin 21?
Yes, KEHONG BIO provides custom synthesis services for Bastadin 21 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.