BAS 00722129
TL;DR: BAS 00722129 (CAS 498529-75-2) is a chemical compound with molecular formula C35H45NO4 and molecular weight 543.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentadecyl 2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate
Also Known As: BAS 00722129, pentadecyl (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)acetate (non-preferred name), pentadecyl (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)acetate, pentadecyl 2-(16,18-dioxo-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0<15,19>]nonad eca-2(7),3,5,9,11,13-hexaen-17-yl)acetate, pentadecyl 2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate
| Molecular Formula | C35H45NO4 |
|---|---|
| Molecular Weight | 543.33 g/mol |
| LogP | 7.513 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 543.33484 |
| Heavy Atoms | 40 |
| Complexity | 1073.918 |
Chemical Identifiers
| CAS Number | 498529-75-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCOC(=O)CN1C(=O)C2C(C1=O)C3C4=CC=CC=C4C2C5=CC=CC=C35 |
Product Overview
BAS 00722129 (CAS 498529-75-2), with molecular formula C35H45NO4 and molecular weight 543.33 g/mol. IUPAC: pentadecyl 2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate.
Chemical Property Profile of BAS 00722129
Property Insights of BAS 00722129
The XLogP value of 7.513 indicates that BAS 00722129 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 00722129. Following Lipinski's Rule of Five, BAS 00722129 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 00722129?
The CAS number of BAS 00722129 is 498529-75-2.
What is the molecular formula of BAS 00722129?
The molecular formula of BAS 00722129 is C35H45NO4.
What is the molecular weight of BAS 00722129?
The molecular weight of BAS 00722129 is 543.33 g/mol.
Where can I buy BAS 00722129?
You can request a quote for BAS 00722129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00722129?
Yes, KEHONG BIO provides custom synthesis services for BAS 00722129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.