BAS 00835126
TL;DR: BAS 00835126 (CAS 485389-41-1) is a chemical compound with molecular formula C38H42BrNO4 and molecular weight 655.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate
Also Known As: BAS 00835126, tridecyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name), tridecyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate, tridecyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate
| Molecular Formula | C38H42BrNO4 |
|---|---|
| Molecular Weight | 655.23 g/mol |
| LogP | 9.0576 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 655.22974 |
| Heavy Atoms | 44 |
| Complexity | 1484.9714 |
Chemical Identifiers
| CAS Number | 485389-41-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)Br |
Product Overview
BAS 00835126 (CAS 485389-41-1), with molecular formula C38H42BrNO4 and molecular weight 655.23 g/mol. IUPAC: tridecyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate.
Chemical Property Profile of BAS 00835126
Property Insights of BAS 00835126
The XLogP value of 9.0576 indicates that BAS 00835126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00835126. Following Lipinski's Rule of Five, BAS 00835126 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00835126?
The CAS number of BAS 00835126 is 485389-41-1.
What is the molecular formula of BAS 00835126?
The molecular formula of BAS 00835126 is C38H42BrNO4.
What is the molecular weight of BAS 00835126?
The molecular weight of BAS 00835126 is 655.23 g/mol.
Where can I buy BAS 00835126?
You can request a quote for BAS 00835126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00835126?
Yes, KEHONG BIO provides custom synthesis services for BAS 00835126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.