BAS 00874438
TL;DR: BAS 00874438 (CAS 499100-41-3) is a chemical compound with molecular formula C38H43NO4 and molecular weight 577.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecyl 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)benzoate
Also Known As: BAS 00874438, tridecyl 2-(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
| Molecular Formula | C38H43NO4 |
|---|---|
| Molecular Weight | 577.32 g/mol |
| LogP | 8.551 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 577.3192 |
| Heavy Atoms | 43 |
| Complexity | 1362.5281 |
Chemical Identifiers
| CAS Number | 499100-41-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46 |
Product Overview
BAS 00874438 (CAS 499100-41-3), with molecular formula C38H43NO4 and molecular weight 577.32 g/mol. IUPAC: tridecyl 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)benzoate.
Chemical Property Profile of BAS 00874438
Property Insights of BAS 00874438
The XLogP value of 8.551 indicates that BAS 00874438 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 00874438. Following Lipinski's Rule of Five, BAS 00874438 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 00874438?
The CAS number of BAS 00874438 is 499100-41-3.
What is the molecular formula of BAS 00874438?
The molecular formula of BAS 00874438 is C38H43NO4.
What is the molecular weight of BAS 00874438?
The molecular weight of BAS 00874438 is 577.32 g/mol.
Where can I buy BAS 00874438?
You can request a quote for BAS 00874438 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00874438?
Yes, KEHONG BIO provides custom synthesis services for BAS 00874438 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.